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Lyndon Emsley

lyndon.emsley@epfl.ch +41 21 693 93 86

EPFL SB ISIC LRM
BCH 1530 (Batochime UNIL)
Av. F.-A. Forel 2
1015 Lausanne

Current Work

Our research centres on the development of new NMR spectroscopy experiments to determine the atomic-level structure and dynamics of complex materials and molecular systems, to solve a range of problems across disciplines.

Publications

Magic Angle Spinning Solid-State 13C Photochemically Induced Dynamic Nuclear Polarization by a Synthetic Donor-Chromophore-Acceptor System at 9.4 T

F. De Biasi; M. A. Hope; Y. Qiu; P. J. Brown; M. Visegradi  et al.

Journal Of Physical Chemistry Letters. 2024-05-15. DOI : 10.1021/acs.jpclett.4c01121.

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Speciation of Lanthanide Metal Ion Dopants in Microcrystalline All-Inorganic Halide Perovskite CsPbCl3

D. J. Kubicki; D. Prochowicz; A. Hofstetter; A. Ummadisingu; L. Emsley

Journal Of The American Chemical Society. 2024-03-28. DOI : 10.1021/jacs.3c11427.

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Optimal sensitivity for 1H detected relayed DNP of organic solids at fast MAS

S. Badoni; P. Berruyer; L. Emsley

Journal Of Magnetic Resonance. 2024-02-23. DOI : 10.1016/j.jmr.2024.107645.

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Axial-Equatorial Halide Ordering in Layered Hybrid Perovskites from Isotropic-Anisotropic 207Pb NMR

M. A. Hope; M. Cordova; A. Mishra; U. Gunes; A. Caiazzo  et al.

Angewandte Chemie-International Edition. 2024-02-19. DOI : 10.1002/anie.202314856.

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Rational Design of Dinitroxide Polarizing Agents for Dynamic Nuclear Polarization to Enhance Overall NMR Sensitivity

A. Venkatesh; G. Casano; R. Wei; Y. Rao; H. Lingua  et al.

Angewandte Chemie-International Edition. 2024-01-24. DOI : 10.1002/anie.202317337.

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Design, Synthesis, and Evaluation of New 1H-Benzo[d]imidazole Based PqsR Inhibitors as Adjuvant Therapy for Pseudomonas aeruginosa Infections

F. Soukarieh; A. Mashabi; W. Richardson; E. V. Oton; M. Romero  et al.

Journal Of Medicinal Chemistry. 2024-01-03. DOI : 10.1021/acs.jmedchem.3c00973.

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Hierarchy of the Components in Spray-Dried, Protein-Excipient Particles Using DNP-Enhanced NMR Spectroscopy

P. Berruyer; M. Lindkvist; S. Gracin; T. Starciuc; A. Bertarello  et al.

Molecular Pharmaceutics. 2023-10-02. DOI : 10.1021/acs.molpharmaceut.3c00539.

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Barriers to resolution in 1H NMR of rotating solids

B. S. de Almeida; D. Torodii; P. Moutzouri; L. Emsley

Journal Of Magnetic Resonance. 2023-09-28. DOI : 10.1016/j.jmr.2023.107557.

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Atomic-level structure determination of amorphous molecular solids by NMR

M. Cordova; P. Moutzouri; S. O. Nilsson Lill; A. Cousen; M. Kearns  et al.

Nature Communications. 2023-08-23. DOI : 10.1038/s41467-023-40853-2.

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Chemical Shift-Dependent Interaction Maps in Molecular Solids

M. Cordova; L. Emsley

Journal Of The American Chemical Society. 2023-07-13. DOI : 10.1021/jacs.3c04538.

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A General Method for The Structure Determination of Amorphous Drugs By NMR

M. Cordova; P. Moutzouri; S. O. N. Lill; A. Cousen; M. Kearns  et al.

2023-07-01. p. A40-A40.

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Optically Enhanced Solid-State H-1 NMR Spectroscopy

F. De Biasi; M. A. Hope; C. E. Avalos; G. Karthikeyan; G. Casano  et al.

Journal Of The American Chemical Society. 2023-06-27. DOI : 10.1021/jacs.3c03937.

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Dynamic nuclear polarisation of 1H in Gd-doped In(OH)3

M. A. Hope; Y. Zhang; A. Venkatesh; L. Emsley

Journal Of Magnetic Resonance. 2023-06-16. DOI : 10.1016/j.jmr.2023.107509.

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Deuterated TEKPol Biradicals and the Spin-Diffusion Barrier in MAS DNP

A. Venkatesh; G. Casano; Y. Rao; F. De Biasi; F. A. Perras  et al.

Angewandte Chemie International Edition. 2023-05-24. DOI : 10.1002/anie.202304844.

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Imaging Radial Distribution Functions of Complex Particles by Relayed Dynamic Nuclear Polarization

P. Berruyer; C. Cibaka-Ndaya; A. Pinon; C. Sanchez; G. L. Drisko  et al.

Journal of the American Chemical Society. 2023-04-19. DOI : 10.1021/jacs.3c01279.

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Two-dimensional Pure Isotropic Proton Solid State NMR

P. Moutzouri; M. Cordova; B. S. de Almeida; D. Torodii; L. Emsley

Angewandte Chemie-International Edition. 2023-04-18. DOI : 10.1002/anie.202301963.

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Improvements in Resolution of 1H NMR of Solids

B. S. de Almeida; L. Emsley

Chimia. 2023-04-01. DOI : 10.2533/chimia.2023.212.

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Imaging radial distribution functions of complex particles by relayed dynamic nuclear polarization

P. Berruyer; C. Cibaka-Ndaya; A. Pinon; C. Sanchez; G. L. Drisko  et al.

2023-03-21.

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Light-Induced Halide Segregation in 2D and Quasi-2D Mixed-Halide Perovskites

K. Datta; A. Caiazzo; M. A. Hope; J. Li; A. Mishra  et al.

Acs Energy Letters. 2023-03-03. DOI : 10.1021/acsenergylett.3c00160.

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Pure Isotropic Proton NMR Spectra in Solids using Deep Learning

M. Cordova; P. Moutzouri; B. S. de Almeida; D. Torodii; L. Emsley

Angewandte Chemie-International Edition. 2023-01-13. DOI : 10.1002/anie.202216607.

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Development of strategies to improve 1H resolution in NMR of solids at 100 kHz magic-angle spinning

B. Simões de Almeida / D. L. Emsley (Dir.)

Lausanne, EPFL, 2023. DOI : 10.5075/epfl-thesis-10556.

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The role of Zn in C-S-H atomic structure, nucleation and growth

A. Morales Melgares / K. Scrivener; D. L. Emsley (Dir.)

Lausanne, EPFL, 2023. DOI : 10.5075/epfl-thesis-10400.

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NMR Crystallography in the Big Data Era: New Methods and Applications Powered by Machine Learning

M. Cordova / D. L. Emsley (Dir.)

Lausanne, EPFL, 2023. DOI : 10.5075/epfl-thesis-10371.

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Dynamic Nuclear Polarization of Inorganic Halide Perovskites

A. Mishra; M. A. Hope; G. Stevanato; D. J. Kubicki; L. Emsley

The Journal of Physical Chemistry C. 2023. DOI : 10.1021/acs.jpcc.3c01527.

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Dynamic Nuclear Polarization of Inorganic Halide Perovskites

A. Mishra; M. A. Hope; G. Stevanato; D. J. Kubicki; L. Emsley

2023.

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Cooperative passivation of perovskite solar cells by alkyldimethylammonium halide amphiphiles

E. A. R. Alharbi; A. Krishna; N. Lempesis; M. Dankl; I. Mosquera-Lois  et al.

Joule. 2023. DOI : 10.1016/j.joule.2022.11.013.

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A Complete Picture of Cation Dynamics in Hybrid Perovskite Materials from Solid-State NMR Spectroscopy

A. Mishra; M. A. Hope; M. Gratzel; L. Emsley

Journal Of The American Chemical Society. 2023. DOI : 10.1021/jacs.2c10149.

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Atomic-Level Structure of Zinc-Modified Cementitious Calcium Silicate Hydrate

A. Morales-Melgares; Z. Casar; P. Moutzouri; A. Venkatesh; M. Cordova  et al.

Journal Of The American Chemical Society. 2022-12-12. DOI : 10.1021/jacs.2c06749.

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A Machine Learning Model of Chemical Shifts for Chemically and Structurally Diverse Molecular Solids

M. Cordova; E. A. Engel; A. Stefaniuk; F. Paruzzo; A. Hofstetter  et al.

Journal Of Physical Chemistry C. 2022-09-22. DOI : 10.1021/acs.jpcc.2c03854.

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H-1 Hyperpolarization of Solutions by Overhauser Dynamic Nuclear Polarization with C-13-H-1 Polarization Transfer

Y. Rao; A. Venkatesh; P. Moutzouri; L. Emsley

Journal Of Physical Chemistry Letters. 2022-08-25. DOI : 10.1021/acs.jpclett.2c01956.

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Dynamic Nuclear Polarization Enables NMR of Surface Passivating Agents on Hybrid Perovskite Thin Films

A. Mishra; M. A. Hope; M. Almalki; L. Pfeifer; S. M. Zakeeruddin  et al.

Journal Of The American Chemical Society. 2022-08-24. DOI : 10.1021/jacs.2c05316.

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Interplay of Kinetic and Thermodynamic Reaction Control Explains Incorporation of Dimethylammonium Iodide into CsPbI3

A. Mishra; D. J. Kubicki; A. Boziki; R. D. Chavan; M. Dankl  et al.

Acs Energy Letters. 2022-08-12. DOI : 10.1021/acsenergylett.2c00877.

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Reply to "Inconsistencies in the specific nucleobase pairing motif prone to photodimerization in a MOF nanoreactor"

S. L. Anderson; P. G. Boyd; A. Gladysiak; T. N. Nguyen; R. G. Palgrave  et al.

Nature Communications. 2022-08-02. DOI : 10.1038/s41467-022-30193-y.

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Design Principles for the Development of Gd(III) Polarizing Agents for Magic Angle Spinning Dynamic Nuclear Polarization

Y. Rao; C. T. Palumbo; A. Venkatesh; M. Keener; G. Stevanato  et al.

Journal Of Physical Chemistry C. 2022-07-05. DOI : 10.1021/acs.jpcc.2c01721.

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H-1 Detected Relayed Dynamic Nuclear Polarization

P. Berruyer; A. Bertarello; S. Bjoergvinsdottir; M. Lelli; L. Emsley

Journal Of Physical Chemistry C. 2022-05-05. DOI : 10.1021/acs.jpcc.2c01077.

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De Novo Crystal Structure Determination from Machine Learned Chemical Shifts

M. Balodis; M. Cordova; A. Hofstetter; G. M. Day; L. Emsley

Journal Of The American Chemical Society. 2022-04-27. DOI : 10.1021/jacs.1c13733.

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In-Cell Quantification of Drugs by Magic-Angle Spinning Dynamic Nuclear Polarization NMR

A. Bertarello; P. Berruyer; M. Artelsmair; C. S. Elmore; S. Heydarkhan-Hagvall  et al.

Journal Of The American Chemical Society. 2022-04-20. DOI : 10.1021/jacs.1c12442.

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Spatial Distribution of Functional Groups in Cellulose Ethers by DNP-Enhanced Solid-State NMR Spectroscopy

P. Berruyer; P. Moutzouri; M. Gericke; D. Jakobi; M. Bardet  et al.

Macromolecules. 2022-04-12. DOI : 10.1021/acs.macromol.2c00061.

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Efficient and Stable Large Bandgap MAPbBr(3) Perovskite Solar Cell Attaining an Open Circuit Voltage of 1.65 V

H. Zhu; L. Pan; F. T. Eickemeyer; M. A. Hope; O. Ouellette  et al.

Acs Energy Letters. 2022-03-11. DOI : 10.1021/acsenergylett.1c02431.

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Hyperpolarized Solution-State NMR Spectroscopy with Optically Polarized Crystals

T. R. Eichhorn; A. J. Parker; F. Josten; C. Mueller; J. Scheuer  et al.

Journal Of The American Chemical Society. 2022-02-16. DOI : 10.1021/jacs.1c09119.

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Magnetic Resonance and Hyperpolarization Methods for Perovskite Photovoltaics

A. Mishra / D. L. Emsley (Dir.)

Lausanne, EPFL, 2022. DOI : 10.5075/epfl-thesis-10046.

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Colloidal-ALD Grown Hybrid Shells Nucleate via a Ligand–Precursor Complex

O. Segura Lecina; M. A. Hope; A. Venkatesh; S. Björgvinsdóttir; K. Rossi  et al.

Journal of the American Chemical Society. 2022. DOI : 10.1021/jacs.1c12538.

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New methods for structure determination and speciation by NMR crystallography

M. Balodis / D. L. Emsley (Dir.)

Lausanne, EPFL, 2022. DOI : 10.5075/epfl-thesis-9004.

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Multi-Length Scale Structure of 2D/3D Dion-Jacobson Hybrid Perovskites Based on an Aromatic Diammonium Spacer

A. Ummadisingu; A. Mishra; D. J. Kubicki; T. LaGrange; A. Ducinskas  et al.

Small. 2021-11-23. DOI : 10.1002/smll.202104287.

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Bayesian probabilistic assignment of chemical shifts in organic solids

M. Cordova; M. Balodis; B. S. de Almeida; M. Ceriotti; L. Emsley

Science Advances. 2021-11-01. DOI : 10.1126/sciadv.abk2341.

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Design and Evaluation of New Quinazolin-4(3H)-one Derived PqsR Antagonists as Quorum Sensing Quenchers in Pseudomonas aeruginosa

F. Soukarieh; A. Mashabi; W. Richardson; E. V. Oton; M. Romero  et al.

Acs Infectious Diseases. 2021-09-10. DOI : 10.1021/acsinfecdis.1c00175.

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Endogenous O-17 Dynamic Nuclear Polarization of Gd-Doped CeO2 from 100 to 370 K

M. A. Hope; S. Bjorgvinsdottir; D. M. Halat; G. Menzildjian; Z. Wang  et al.

Journal Of Physical Chemistry C. 2021-09-02. DOI : 10.1021/acs.jpcc.1c04479.

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Theory and simulations of homonuclear three-spin systems in rotating solids

B. S. de Almeida; P. Moutzouri; G. Stevanato; L. Emsley

Journal Of Chemical Physics. 2021-08-28. DOI : 10.1063/5.0055583.

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NMR spectroscopy probes microstructure, dynamics and doping of metal halide perovskites

D. J. Kubicki; S. D. Stranks; C. P. Grey; L. Emsley

Nature Reviews Chemistry. 2021-08-13. DOI : 10.1038/s41570-021-00309-x.

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Naphthalenediimide/Formamidinium-Based Low-Dimensional Perovskites

A. Mishra; P. Ahlawat; G. C. Fish; F. Jahanbakhshi; M. Mladenovic  et al.

Chemistry of Materials. 2021-08-11. DOI : 10.1021/acs.chemmater.1c01635.

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Structure determination of amorphous molecular solids by NMR crystallography

L. Emsley

2021-08-01. p. C465-C465. DOI : 10.1107/S0108767321092217.

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Pure Isotropic Proton Solid State NMR

P. Moutzouri; B. S. de Almeida; D. Torodii; L. Emsley

Journal Of The American Chemical Society. 2021-07-07. DOI : 10.1021/jacs.1c03315.

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Quantification of magic angle spinning dynamic nuclear polarization NMR spectra

A. Bertarello; P. Berruyer; U. Skantze; S. Sardana; M. Sardana  et al.

Journal of Magnetic Resonance. 2021-06-28. DOI : 10.1016/j.jmr.2021.107030.

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Two-step immobilization of metronidazole prodrug on TEMPO cellulose nanofibrils through thiol-yne click chemistry for in situ controlled release

H. Durand; I. Baussanne; M. Demeunynck; J. Viger-Gravel; L. Emsley  et al.

Carbohydrate Polymers. 2021-06-15. DOI : 10.1016/j.carbpol.2021.117952.

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Multimodal host–guest complexation for efficient and stable perovskite photovoltaics

H. Zhang; F. T. Eickemeyer; Z. Zhou; M. Mladenović; F. Jahanbakhshi  et al.

Nature Communications. 2021-06-07. DOI : 10.1038/s41467-021-23566-2.

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High Sensitivity Detection of a Solubility Limiting Surface Transformation of Drug Particles by DNP SENS

J. Viger-Gravel; A. C. Pinon; S. Bjoergvinsdottir; U. Skantze; A. S. Ankarberg  et al.

Journal Of Pharmaceutical Sciences. 2021-06-01. DOI : 10.1016/j.xphs.2020.12.037.

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Structure determination of an amorphous drug through large-scale NMR predictions

M. Cordova; M. Balodis; A. Hofstetter; F. Paruzzo; S. O. N. Lill  et al.

Nature Communications. 2021-05-20. DOI : 10.1038/s41467-021-23208-7.

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Decoupling the effects of defects on efficiency and stability through phosphonates in stable halide perovskite solar cells

H. Xie; Z. Wang; Z. Chen; C. Pereyra; M. Pols  et al.

Joule. 2021-05-19. DOI : 10.1016/j.joule.2021.04.003.

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Benzylammonium‐Mediated Formamidinium Lead Iodide Perovskite Phase Stabilization for Photovoltaics

A. Q. Alanazi; M. H. Almalki; A. Mishra; D. J. Kubicki; Z. Wang  et al.

Advanced Functional Materials. 2021-05-19. DOI : 10.1002/adfm.202101163.

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The Atomic-Level Structure of Cementitious Calcium Aluminate Silicate Hydrate Determined by NMR

P. Moutzouri; L. Emsley

Chimia. 2021-04-01. DOI : 10.2533/chimia.2021.272.

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Bulk Hyperpolarization of Inorganic Materials

S. Bjorgvinsdottir; L. Emsley

Chimia. 2021-04-01. DOI : 10.2533/chimia.2021.333.

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Advanced characterization of regioselectively substituted methylcellulose model compounds by DNP enhanced solid-state NMR spectroscopy

P. Berruyer; M. Gericke; P. Moutzouri; D. Jakobi; M. Bardet  et al.

Carbohydrate Polymers. 2021-03-15. DOI : 10.1016/j.carbpol.2021.117944.

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Similarities and Differences among Protein Dynamics Studied by Variable Temperature Nuclear Magnetic Resonance Relaxation

B. Busi; J. R. Yarava; A. Bertarello; F. Freymond; W. Adamski  et al.

Journal Of Physical Chemistry B. 2021-03-11. DOI : 10.1021/acs.jpcb.0c10188.

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Unravelling the Behavior of Dion-Jacobson Layered Hybrid Perovskites in Humid Environments

A. Ducinskas; G. Y. Kim; D. Moia; A. Senocrate; Y.-R. Wang  et al.

Acs Energy Letters. 2021-02-12. DOI : 10.1021/acsenergylett.0c02344.

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Iron incorporation in synthetic precipitated calcium silicate hydrates

J. Siramanont; B. J. Walder; L. Emsley; P. Bowen

Cement and Concrete Research. 2021-01-26. DOI : 10.1016/j.cemconres.2021.106365.

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Solid-state NMR spectroscopy

B. Reif; S. E. Ashbrook; L. Emsley; M. Hong

Nature Reviews Methods Primers. 2021-01-14. DOI : 10.1038/s43586-020-00002-1.

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Nanoscale Phase Segregation in Supramolecular π-Templating for Hybrid Perovskite Photovoltaics from NMR Crystallography

M. A. Hope; T. Nakamura; P. Ahlawat; A. Mishra; M. Cordova  et al.

Journal of the American Chemical Society. 2021-01-14. DOI : 10.1021/jacs.0c11563.

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Scaling analyses for hyperpolarization transfer across a spin-diffusion barrier and into bulk solid media

N. A. Prisco; A. C. Pinon; L. Emsley; B. F. Chmelka

Physical Chemistry Chemical Physics. 2021-01-14. DOI : 10.1039/d0cp03195j.

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A Magic Angle Spinning Activated O-17 DNP Raser

M. A. Hope; S. Bjorgvinsdottir; C. P. Grey; L. Emsley

Journal Of Physical Chemistry Letters. 2021-01-14. DOI : 10.1021/acs.jpclett.0c03457.

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Pseudo-halide anion engineering for α-FAPbI3 perovskite solar cells

J. Jeong; M. Kim; J. Seo; H. Lu; P. Ahlawat  et al.

Nature. 2021-04-05. DOI : 10.1038/s41586-021-03406-5.

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MAS NMR Studies of Hierarchical Interplay in Protein Dynamics

B. Busi / D. L. Emsley (Dir.)

Lausanne, EPFL, 2021. DOI : 10.5075/epfl-thesis-8172.

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Hyperpolarization of inorganic solids

S. Björgvinsdóttir / D. L. Emsley (Dir.)

Lausanne, EPFL, 2021. DOI : 10.5075/epfl-thesis-8117.

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Hyperpolarization transfer pathways in inorganic materials

S. Björgvinsdóttir; P. Moutzouri; B. J. Walder; N. Matthey; L. Emsley

Journal of Magnetic Resonance. 2020-12-05. DOI : 10.1016/j.jmr.2020.106888.

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Crown Ether Modulation Enables over 23% Efficient Formamidinium-Based Perovskite Solar Cells

T.-S. Su; F. T. Eickemeyer; M. A. Hope; F. Jahanbakhshi; M. Mladenovic  et al.

Journal Of The American Chemical Society. 2020-11-25. DOI : 10.1021/jacs.0c08592.

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Multimodal Response to Copper Binding in Superoxide Dismutase Dynamics

M. Bonaccorsi; M. J. Knight; T. Le Marchand; H. R. W. Dannatt; T. Schubeis  et al.

Journal Of The American Chemical Society. 2020-11-18. DOI : 10.1021/jacs.0c09242.

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Fast remote correlation experiments for 1H homonuclear decoupling in solids

P. Moutzouri; B. Simões de Almeida; L. Emsley

Journal of Magnetic Resonance. 2020-10-22. DOI : 10.1016/j.jmr.2020.106856.

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Vapor-assisted deposition of highly efficient, stable black-phase FAPbI(3) perovskite solar cells

H. Lu; Y. Liu; P. Ahlawat; A. Mishra; W. R. Tress  et al.

Science. 2020-10-02. DOI : 10.1126/science.abb8985.

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Picometer Resolution Structure of the Coordination Sphere in the Metal-Binding Site in a Metalloprotein by NMR

A. Bertarello; L. Benda; K. J. Sanders; A. J. Pell; M. J. Knight  et al.

Journal Of The American Chemical Society. 2020-09-30. DOI : 10.1021/jacs.0c07339.

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Dynamic Nuclear Polarization Enhancement of 200 at 21.15 T Enabled by 65 kHz Magic Angle Spinning

P. Berruyer; S. Björgvinsdóttir; A. Bertarello; G. Stevanato; Y. Rao  et al.

Journal of Physical Chemistry Letters. 2020-09-22. DOI : 10.1021/acs.jpclett.0c02493.

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Cd-113 Solid-State NMR at 21.1 T Reveals the Local Structure and Passivation Mechanism of Cadmium in Hybrid and All-Inorganic Halide Perovskites

D. J. Kubicki; D. Prochowicz; A. Hofstetter; B. J. Walder; L. Emsley

Acs Energy Letters. 2020-09-11. DOI : 10.1021/acsenergylett.0c01420.

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Sensitivity Enhancements in Lithium Titanates by Incipient Wetness Impregnation DNP NMR

S. Bjorgvinsdottir; P. Moutzouri; P. Berruyer; M. A. Hope; L. Emsley

Journal Of Physical Chemistry C. 2020-07-30. DOI : 10.1021/acs.jpcc.0c05105.

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Enhanced Intersystem Crossing and Transient Electron Spin Polarization in a Photoexcited Pentacene–Trityl Radical

C. E. Avalos; S. Richert; E. Socie; G. Karthikeyan; G. Casano  et al.

The Journal of Physical Chemistry. 2020-07-23. DOI : 10.1021/acs.jpca.0c03498.

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The Atomic-Level Structure of Cementitious Calcium Aluminate Silicate Hydrate

A. K. Mohamed; P. Moutzouri; P. Berruyer; B. J. Walder; J. Siramanont  et al.

Journal Of The American Chemical Society. 2020-06-24. DOI : 10.1021/jacs.0c02988.

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Colloidal-ALD-Grown Core/Shell CdSe/CdS Nanoplatelets as Seen by DNP Enhanced PASS-PIETA NMR Spectroscopy

L. Piveteau; D. N. Dirin; C. P. Gordon; B. J. Walder; T.-C. Ong  et al.

Nano Letters. 2020-05-13. DOI : 10.1021/acs.nanolett.9b04870.

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Local Structure and Dynamics in Methylammonium, Formamidinium, and Cesium Tin(II) Mixed-Halide Perovskites from Sn-119 Solid-State NMR

D. J. Kubicki; D. Prochowicz; E. Salager; A. Rakhmatullin; C. P. Grey  et al.

Journal Of The American Chemical Society. 2020-04-29. DOI : 10.1021/jacs.0c00647.

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TinyPols: a family of water-soluble binitroxides tailored for dynamic nuclear polarization enhanced NMR spectroscopy at 18.8 and 21.1 T

A. Lund; G. Casano; G. Menzildjian; M. Kaushik; G. Stevanato  et al.

Chemical Science. 2020-03-14. DOI : 10.1039/c9sc05384k.

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Structural and DNA binding properties of mycobacterial integration host factor mIHF

N. T. Odermatt; M. Lelli; T. Herrmann; L. A. Abriata; A. Japaridze  et al.

Journal Of Structural Biology. 2020-03-01. DOI : 10.1016/j.jsb.2019.107434.

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Atomistic origins of the limited phase stability of Cs+-rich FAxCs(1-x)PbI3 mixtures

A. Boziki; D. J. Kubicki; A. Mishra; S. Meloni; L. Emsley  et al.

Chemistry of Materials. 2020-02-21. DOI : 10.1021/acs.chemmater.0c00120.

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Homonuclear Decoupling in H-1 NMR of Solids by Remote Correlation

P. Moutzouri; F. M. Paruzzo; B. S. de Almeida; G. Stevanato; L. Emsley

Angewandte Chemie-International Edition. 2020-02-19. DOI : 10.1002/anie.201916335.

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Cellulose phosphorylation comparison and analysis of phosphorate position on cellulose fibers

F. Rol; C. Sillard; M. Bardet; J. R. Yarava; L. Emsley  et al.

Carbohydrate Polymers. 2020-02-01. DOI : 10.1016/j.carbpol.2019.115294.

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Intermediate Phase Enhances Inorganic Perovskite and Metal Oxide Interface for Efficient Photovoltaics

J. Zhang; Z. Wang; A. Mishra; M. Yu; M. Shasti  et al.

Joule. 2020-01-15. DOI : 10.1016/j.joule.2019.11.007.

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Open and Closed Radicals: Local Geometry around Unpaired Electrons Governs Magic-Angle Spinning Dynamic Nuclear Polarization Performance

G. Stevanato; G. Casano; D. J. Kubicki; Y. Rao; L. Esteban Hofer  et al.

Journal of the American Chemical Society. 2020. DOI : 10.1021/jacs.0c04911.

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Guanine‐Stabilized Formamidinium Lead Iodide Perovskites

L. Hong; J. V. Milic; P. Ahlawat; M. Mladenovic; D. J. Kubicki  et al.

Angewandte Chemie. 2020. DOI : 10.1002/anie.201912051.

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Supramolecular Modulation of Hybrid Perovskite Solar Cells via Bifunctional Halogen Bonding Revealed by Two-Dimensional 19F Solid-State NMR Spectroscopy

M. A. Ruiz Preciado; D. J. Kubicki; A. Hofstetter; L. McGovern; M. H. Futscher  et al.

Journal of the American Chemical Society. 2020-01-08. DOI : 10.1021/jacs.9b13701.

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Topology of Pretreated Wood Fibers Using Dynamic Nuclear Polarization

J. Viger-Gravel; W. Lan; A. C. Pinon; P. Berruyer; L. Emsley  et al.

Journal Of Physical Chemistry C. 2019-12-19. DOI : 10.1021/acs.jpcc.9b09272.

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High-resolution H-1 NMR of powdered solids by homonuclear dipolar decoupling

F. M. Paruzzo; L. Emsley

Journal Of Magnetic Resonance. 2019-12-01. DOI : 10.1016/j.jmr.2019.106598.

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Rapid Structure Determination of Molecular Solids Using Chemical Shifts Directed by Unambiguous Prior Constraints

A. Hofstetter; M. Balodis; F. M. Paruzzo; C. M. Widdifield; G. Steyanato  et al.

Journal of The American Chemical Society. 2019-10-23. DOI : 10.1021/jacs.9b03908.

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Ba-induced phase segregation and band gap reduction in mixed-halide inorganic perovskite solar cells

W. Xiang; Z. Wang; D. J. Kubicki; X. Wang; W. Tress  et al.

Nature Communications. 2019-10-15. DOI : 10.1038/s41467-019-12678-5.

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Atomic-Level Microstructure of Efficient Formamidinium-Based Perovskite Solar Cells Stabilized by 5-Ammonium Valeric Acid Iodide Revealed by Multinuclear and Two-Dimensional Solid-State NMR

A. Q. M. Alanazi; D. J. Kubicki; D. Prochowicz; E. A. R. Alharbi; M. E. F. Bouduban  et al.

Journal of the American Chemical Society. 2019-10-08. DOI : 10.1021/jacs.9b07381.

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Structural description of surfaces and interfaces in biominerals by DNP SENS

T. Azais; S. Von Euw; W. Ajili; S. Auzoux-Bordenave; P. Bertani  et al.

Solid State Nuclear Magnetic Resonance. 2019-10-01. DOI : 10.1016/j.ssnmr.2019.06.001.

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Measurement of Proton Spin Diffusivity in Hydrated Cementitious Solids

B. J. Walder; N. A. Prisco; F. M. Paruzzo; J. R. Yarava; B. F. Chmelka  et al.

Journal of Physical Chemistry Letters. 2019-09-05. DOI : 10.1021/acs.jpclett.9b01861.

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Line narrowing in H-1 NMR of powdered organic solids with TOP-CT-MAS experiments at ultra-fast MAS

F. M. Paruzzo; B. J. Walder; L. Emsley

Journal Of Magnetic Resonance. 2019-08-01. DOI : 10.1016/j.jmr.2019.06.015.

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Atomic-level passivation mechanism of ammonium salts enabling highly efficient perovskite solar cells

E. A. Alharbi; A. Y. Alyamani; D. J. Kubicki; A. R. Uhl; B. J. Walder  et al.

Nature Communications. 2019-07-08. DOI : 10.1038/s41467-019-10985-5.

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Lead-Oxygen Bond Length Distributions of the Relaxor Ferroelectric 0.67PbMg(1/3)Nb(2/3)O(3)-0.33PbTiO(3) from Pb-207 Nuclear Magnetic Resonance

C. E. Avalos; B. J. Walder; L. Emsley

Journal Of Physical Chemistry C. 2019-06-27. DOI : 10.1021/acs.jpcc.9b04001.

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Dynamic Nuclear Polarization Magic-Angle Spinning Nuclear Magnetic Resonance Combined with Molecular Dynamics Simulations Permits Detection of Order and Disorder in Viral Assemblies

R. Gupta; H. Zhang; M. Lu; G. Hou; M. Caporini  et al.

Journal Of Physical Chemistry B. 2019-06-20. DOI : 10.1021/acs.jpcb.9b02293.

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A Factor Two Improvement in High-Field Dynamic Nuclear Polarization from Gd(III) Complexes by Design

G. Stevanato; D. J. Kubicki; G. Menzildjian; A.-S. Chauvin; K. Keller  et al.

Journal Of The American Chemical Society. 2019-06-05. DOI : 10.1021/jacs.9b03723.

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F-19 Magic Angle Spinning Dynamic Nuclear Polarization Enhanced NMR Spectroscopy

J. Viger-Gravel; C. E. Avalos; D. J. Kubicki; D. Gajan; M. Lelli  et al.

Angewandte Chemie-International Edition. 2019-05-27. DOI : 10.1002/anie.201814416.

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Supramolecular Engineering for Formamidinium-Based Layered 2D Perovskite Solar Cells: Structural Complexity and Dynamics Revealed by Solid-State NMR Spectroscopy

J. V. Milic; J.-H. Im; D. J. Kubicki; A. Ummadisingu; J.-Y. Seo  et al.

Advanced Energy Materials. 2019-05-23. DOI : 10.1002/aenm.201900284.

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Nucleobase pairing and photodimerization in a biologically derived metal-organic framework nanoreactor

S. L. Anderson; P. G. Boyd; A. Gladysiak; T. N. Nguyen; R. G. Palgrave  et al.

Nature Communications. 2019-04-08. DOI : 10.1038/s41467-019-09486-2.

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Multifunctional Molecular Modulation for Efficient and Stable Hybrid Perovskite Solar Cells

J. V. Milic; D. J. Kubicki; L. Emsley; M. Gratzel

Chimia. 2019-04-01. DOI : 10.2533/chimia.2019.317.

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Solid-state NMR approaches to lead halide perovskites

D. Kubicki; D. Prochowicz; A. Hofstetter; M. Graetzel; L. Emsley

2019-03-31. National Meeting of the American-Chemical-Society (ACS), Orlando, FL, Mar 31-Apr 04, 2019.

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Atomic-level structures of the organic-inorganic interface by NMR crystallography

L. Emsley

2019-03-31. National Meeting of the American-Chemical-Society (ACS), Orlando, FL, Mar 31-Apr 04, 2019.

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Characterization of semiconductor nanocrystals using advanced NMR spectroscopy

L. Piveteau; T.-C. Ong; B. Walder; D. Dirin; D. Moscheni  et al.

2019-03-31. National Meeting of the American-Chemical-Society (ACS), Orlando, FL, Mar 31-Apr 04, 2019.

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One- and Two-Dimensional High-Resolution NMR from Flat Surfaces

B. J. Walder; C. Berk; W.-C. Liao; A. J. Rossini; M. Schwarzwaelder  et al.

Acs Central Science. 2019-03-27. DOI : 10.1021/acscentsci.8b00916.

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Maximizing nuclear hyperpolarization in pulse cooling under MAS

S. Bjorgyinsdottir; B. J. Walder; N. Matthey; L. Emsley

Journal Of Magnetic Resonance. 2019-03-01. DOI : 10.1016/j.jmr.2019.01.011.

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Doping and phase segregation in Mn2+- and Co2+-doped lead halide perovskites from Cs-133 and H-1 NMR relaxation enhancement

D. J. Kubicki; D. Prochowicz; A. Pinon; G. Stevanato; A. Hofstetter  et al.

Journal of Materials Chemistry A. 2019-02-07. DOI : 10.1039/c8ta11457a.

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Chemical exchange at the ferroelectric phase transition of lead germanate revealed by solid state Pb-207 nuclear magnetic resonance

C. E. Avalos; B. J. Walder; J. Viger-Gravel; A. Magrez; L. Emsley

Physical Chemistry Chemical Physics. 2019-01-21. DOI : 10.1039/c8cp06507a.

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Europium-Doped CsPbI2Br for Stable and Highly Efficient Inorganic Perovskite Solar Cells

W. Xiang; Z. Wang; D. J. Kubicki; W. Tress; J. Luo  et al.

Joule. 2019-01-16. DOI : 10.1016/j.joule.2018.10.008.

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New Approaches to NMR Crystallography

F. M. Paruzzo / D. L. Emsley (Dir.)

Lausanne, EPFL, 2019. DOI : 10.5075/epfl-thesis-7523.

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Advanced Computational Methods for NMR Crystallography

A. Hofstetter / D. L. Emsley (Dir.)

Lausanne, EPFL, 2019. DOI : 10.5075/epfl-thesis-7463.

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A Bayesian approach to NMR crystal structure determination

E. A. Engel; A. Anelli; A. Hofstetter; F. M. Paruzzo; L. Emsley  et al.

Physical Chemistry Chemical Physics. 2019. DOI : 10.1039/C9CP04489B.

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Core-Shell Structure of Organic Crystalline Nanoparticles Determined by Relayed Dynamic Nuclear Polarization NMR

A. C. Pinon; U. Skantze; J. Viger-Gravel; S. Schantz; L. Emsley

Journal Of Physical Chemistry A. 2018-11-08. DOI : 10.1021/acs.jpca.8b08630.

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Addition of adamantylammonium iodide to hole transport layers enables highly efficient and electroluminescent perovskite solar cells

M. M. Tavakoli; W. Tress; J. V. Milic; D. Kubicki; L. Emsley  et al.

Energy & Environmental Science. 2018-11-01. DOI : 10.1039/c8ee02404a.

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Probing Protein Dynamics Using Multifield Variable Temperature NMR Relaxation and Molecular Dynamics Simulation

B. Busi; J. R. Yarava; A. Hofstetter; N. Salvi; D. Cala-De Paepe  et al.

Journal Of Physical Chemistry B. 2018-10-25. DOI : 10.1021/acs.jpcb.8b08578.

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BDPA-Nitroxide Biradicals Tailored for Efficient Dynamic Nuclear Polarization Enhanced Solid-State NMR at Magnetic Fields up to 21.1 T

D. Wisser; G. Karthikeyan; A. Lund; G. Casano; H. Karoui  et al.

Journal Of The American Chemical Society. 2018-10-17. DOI : 10.1021/jacs.8b08081.

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Resolving the Core and the Surface of CdSe Quantum Dots and Nanoplatelets Using Dynamic Nuclear Polarization Enhanced PASS-PIETA NMR Spectroscopy

L. Piveteau; T.-C. Ong; B. J. Walder; D. N. Dirin; D. Moscheni  et al.

Acs Central Science. 2018-09-26. DOI : 10.1021/acscentsci.8b00196.

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Solvent effects on the polarization transfer between a photo-excited spin-polarized radical pair and a TEMPO radical

C. Avalos; G. Stevenato; S. Richert; G. Karthikeyan; O. Ouari  et al.

2018-08-19. 256th National Meeting and Exposition of the American-Chemical-Society (ACS) - Nanoscience, Nanotechnology and Beyond, Boston, MA, Aug 19-23, 2018.

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207Pb NMR of ferroelectric perovskite lead germanate at and below the paraelectric phase transition

C. Avalos; B. Walder; J. Viger-Gravel; L. Emsley

2018-08-19. 256th National Meeting and Exposition of the American-Chemical-Society (ACS) - Nanoscience, Nanotechnology and Beyond, Boston, MA, Aug 19-23, 2018.

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Using 207Pb NMR to investigate temperature dependent nuclear spin relaxation and Pb-O bond covalency in relaxor ferroelectrics

C. Avalos; B. Walder; L. Emsley

2018-08-19. 256th National Meeting and Exposition of the American-Chemical-Society (ACS) - Nanoscience, Nanotechnology and Beyond, Boston, MA, Aug 19-23, 2018.

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Structure of Lipid Nanoparticles Containing siRNA or mRNA by Dynamic Nuclear Polarization-Enhanced NMR Spectroscopy

J. Viger-Gravel; A. Schantz; A. C. Pinon; A. J. Rossini; S. Schantz  et al.

The Journal of Physical Chemistry. 2018-02-22. DOI : 10.1021/acs.jpcb.7b10795.

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Chemical shifts in molecular solids by machine learning

F. M. Paruzzo; A. Hofstetter; F. Musil; S. De; M. Ceriotti  et al.

Nature Communications. 2018. DOI : 10.1038/s41467-018-06972-x.

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DNP in Materials Science: Touching the Surface

P. Berruyer; L. Emsley; A. Lesage

Emagres. 2018-01-01. DOI : 10.1002/9780470034590.emrstm1554.

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Multifunctional molecular modulators for perovskite solar cells with over 20% efficiency and high operational stability

D. Bi; X. Li; J. V. Milić; D. J. Kubicki; N. Pellet  et al.

Nature Communications. 2018. DOI : 10.1038/s41467-018-06709-w.

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Solid-state NMR approaches to inorganic materials: From lead-halide perovskites to gallium phosphide

L. Emsley

2018.

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Refocused linewidths less than 10 Hz in H-1 solid-state NMR

F. Paruzzo; G. Stevanato; M. Halse; J. Schlagnitweit; D. Mammoli  et al.

JOURNAL OF MAGNETIC RESONANCE. 2018. DOI : 10.1016/j.jmr.2018.06.001.

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Predicting the DNP-SENS efficiency in reactive heterogeneous catalysts from hydrophilicity

E. Pump; A. Bendjeriou-Sedjerari; J. Viger-Gravel; D. Gajan; B. Scotto  et al.

CHEMICAL SCIENCE. 2018. DOI : 10.1039/c8sc00532j.

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Phase Segregation in Potassium-Doped Lead Halide Perovskites from K-39 Solid-State NMR at 21.1 T

D. Kubicki; D. Prochowicz; A. Hofstetter; S. Zakeeruddin; M. Gratzel  et al.

Journal of the American Chemical Society. 2018. DOI : 10.1021/jacs.8b03191.

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One-step mechanochemical incorporation of an insoluble cesium additive for high performance planar heterojunction solar cells

D. Prochowicz; P. Yadav; M. Saliba; D. Kubicki; M. Tavakoli  et al.

NANO ENERGY. 2018. DOI : 10.1016/j.nanoen.2018.05.010.

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Hyperpolarized long-lived nuclear spin states in monodeuterated methyl groups

S. Elliott; B. Meier; B. Vuichoud; G. Stevanato; L. Brown  et al.

Physical Chemistry Chemical Physics. 2018. DOI : 10.1039/c8cp00253c.

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Elucidating an Amorphous Form Stabilization Mechanism for Tenapanor Hydrochloride: Crystal Structure Analysis Using X-ray Diffraction, NMR Crystallography, and Molecular Modeling

S. Lill; C. Widdifield; A. Pettersen; A. Ankarberg; M. Lindkvist  et al.

MOLECULAR PHARMACEUTICS. 2018. DOI : 10.1021/acs.molpharmaceut.7b01047.

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DNP-enhanced solid-state NMR spectroscopy of active pharmaceutical ingredients

L. Zhao; A. Pinon; L. Emsley; A. Rossini

MAGNETIC RESONANCE IN CHEMISTRY. 2018. DOI : 10.1002/mrc.4688.

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DNP enhanced NMR with flip-back recovery

S. Bjorgvinsdottir; B. Walder; A. Pinon; J. Yarava; L. Emsley

JOURNAL OF MAGNETIC RESONANCE. 2018. DOI : 10.1016/j.jmr.2018.01.017.

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Direct observation of three-dimensional atomic-level structures on the surface of catalytic nanoparticles

L. Emsley

2018. 255th National Meeting and Exposition of the American-Chemical-Society (ACS) - Nexus of Food, Energy, and Water, New Orleans, LA, Mar 18-22, 2018.

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Bulk Nuclear Hyperpolarization of Inorganic Solids by Relay from the Surface

S. Bjorgvinsdottir; B. Walder; A. Pinon; L. Emsley

Journal of the American Chemical Society. 2018. DOI : 10.1021/jacs.8b03883.

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Spin Diffusion in Dynamic Nuclear Polarization Nuclear Magnetic Resonance

A. C. Pinon / D. L. Emsley (Dir.)

Lausanne, EPFL, 2018. DOI : 10.5075/epfl-thesis-8519.

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Formation of Stable Mixed Guanidinium–Methylammonium Phases with Exceptionally Long Carrier Lifetimes for High-Efficiency Lead Iodide-Based Perovskite Photovoltaics

D. J. Kubicki; D. Prochowicz; A. Hofstetter; M. Saski; P. Yadav  et al.

Journal of the American Chemical Society. 2018-02-21. DOI : 10.1021/jacs.7b12860.

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Surface-Enhanced NMR Spectroscopy

D. J. Kubicki / D. L. Emsley (Dir.)

Lausanne, EPFL, 2018. DOI : 10.5075/epfl-thesis-8374.

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Structure of outer membrane protein G in lipid bilayers

J. S. Retel; A. J. Nieuwkoop; M. Hiller; V. A. Higman; E. Barbet-Massin  et al.

Nature Communications. 2017. DOI : 10.1038/s41467-017-02228-2.

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Molecular bases of D76N beta-2 microglobulin pathologic aggregation propensity

T. Le Marchand; L. B. Andreas; N. Salvi; M. Bolognesi; V. Bellotti  et al.

2017. 19th IUPAB Congress / 11th EBSA Congress, British Biophys Soc, Edinburgh, SCOTLAND, JUL 16-20, 2017. p. S347-S347.

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Cation Dynamics in Mixed-Cation (MA)(x)(FA)(1-x)PbI3 Hybrid Perovskites from Solid-State NMR

D. J. Kubicki; D. Prochowicz; A. Hofstetter; P. Pechy; S. M. Zakeeruddin  et al.

Journal Of The American Chemical Society. 2017. DOI : 10.1021/jacs.7b04930.

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Phase Segregation in Cs-, Rb- and K-Doped Mixed-Cation (MA)(x)(FA)(1-x)Pbl(3) Hybrid Perovskites from Solid-State NMR

D. J. Kubicki; D. Prochowicz; A. Hofstetter; S. M. Zakeeruddin; M. Graetzel  et al.

Journal Of The American Chemical Society. 2017. DOI : 10.1021/jacs.7b07223.

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Determining the Surface Structure of Silicated Alumina Catalysts via Isotopic Enrichment and Dynamic Nuclear Polarization Surface-Enhanced NMR Spectroscopy

A. G. M. Rankin; P. B. Webb; D. M. Dawson; J. Viger-Gravel; B. J. Walder  et al.

Journal Of Physical Chemistry C. 2017. DOI : 10.1021/acs.jpcc.7608137.

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The Atomic-Level Structure of Cementitious Calcium Silicate Hydrate

A. Kumar; B. J. Walder; A. K. Mohamed; A. Hofstetter; B. Srinivasan  et al.

Journal Of Physical Chemistry C. 2017. DOI : 10.1021/acs.jpcc.7b02439.

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The structure and binding mode of citrate in the stabilization of gold nanoparticles

H. Al-Johani; E. Abou-Hamad; A. Jedidi; C. M. Widdifield; J. Viger-Gravel  et al.

Nature Chemistry. 2017. DOI : 10.1038/Nchem.2752.

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Local Structures and Heterogeneity of Silica-Supported M(III) Sites Evidenced by EPR, IR, NMR, and Luminescence Spectroscopies

M. F. Delley; G. Lapadula; F. Nunez-Zarur; A. Comas-Vives; V. Kalendra  et al.

Journal Of The American Chemical Society. 2017. DOI : 10.1021/jacs.7b02179.

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Does Z' equal 1 or 2? Enhanced powder NMR crystallography verification of a disordered room temperature crystal structure of a p38 inhibitor for chronic obstructive pulmonary disease

C. M. Widdifield; S. O. N. Lill; A. Broo; M. Lindkvist; A. Pettersen  et al.

Physical Chemistry Chemical Physics. 2017. DOI : 10.1039/c7cp02349a.

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Frozen Acrylamide Gels as Dynamic Nuclear Polarization Matrices

J. Viger-Gravel; P. Berruyer; D. Gajan; J.-M. Basset; A. Lesage  et al.

Angewandte Chemie-International Edition. 2017. DOI : 10.1002/anie.201703758.

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Measuring Nano- to Microstructures from Relayed Dynamic Nuclear Polarization NMR

A. C. Pinon; J. Schlagnitweit; P. Berruyer; A. J. Rossini; M. Lelli  et al.

Journal Of Physical Chemistry C. 2017. DOI : 10.1021/acs.jpcc.7b04438.

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Dynamic Nuclear Polarization Efficiency Increased by Very Fast Magic Angle Spinning

S. R. Chaudhari; D. Wisser; A. C. Pinon; P. Berruyer; D. Gajan  et al.

Journal Of The American Chemical Society. 2017. DOI : 10.1021/jacs.7b05194.

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Tailored Polarizing Hybrid Solids with Nitroxide Radicals Localized in Mesostructured Silica Walls

D. L. Silverio; H. A. Van Kalkeren; T.-C. Ong; M. Baudin; M. Yulikov  et al.

Helvetica Chimica Acta. 2017. DOI : 10.1002/hlca.201700101.

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Solvent suppression in DNP enhanced solid state NMR

J. R. Yarava; S. R. Chaudhari; A. J. Rossini; A. Lesage; L. Emsley

Journal Of Magnetic Resonance. 2017. DOI : 10.1016/j.jmr.2017.02.016.

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Positional Variance in NMR Crystallography

A. Hofstetter; L. Emsley

Journal Of The American Chemical Society. 2017. DOI : 10.1021/jacs.6b12705.

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Oxygen-17 dynamic nuclear polarisation enhanced solid-state NMR spectroscopy at 18.8 T

N. J. Brownbill; D. Gajan; A. Lesage; L. Emsley; F. Blanc

Chemical Communications. 2017. DOI : 10.1039/c6cc09743j.

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Donor-acceptor stacking arrangements in bulk and thin-film high-mobility conjugated polymers characterized using molecular modelling and MAS and surface-enhanced solid-state NMR spectroscopy

S. R. Chaudhari; J. M. Griffin; K. Broch; A. Lesage; V. Lemaur  et al.

Chemical Science. 2017. DOI : 10.1039/c7sc00053g.

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Three-Dimensional Structure Determination of Surface Sites

P. Berruyer; M. Lelli; M. P. Conley; D. L. Silverio; C. M. Widdifield  et al.

Journal Of The American Chemical Society. 2017. DOI : 10.1021/jacs.6b10894.

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Dendritic polarizing agents for DNP SENS

W.-C. Liao; T.-C. Ong; D. Gajan; F. Bernada; C. Sauvee  et al.

Chemical Science. 2017. DOI : 10.1039/c6sc03139k.

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Reactive surface organometallic complexes observed using dynamic nuclear polarization surface enhanced NMR spectroscopy

E. Pump; J. Viger-Gravel; E. Abou-Hamad; M. K. Samantaray; B. Hamzaoui  et al.

Chemical Science. 2017. DOI : 10.1039/c6sc02379g.

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Transportable hyperpolarized metabolites

X. Ji; A. Bornet; B. Vuichoud; J. Milani; D. Gajan  et al.

Nature Communications. 2017. DOI : 10.1038/ncomms13975.

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Structured and porous materials particularly suitable as polarizing agents in dissolution dynamic nuclear polarization

C. Thieuleux; L. Veyre; D. Baudouin; C. Coperet; L. Emsley  et al.

WO2016038131 . 2016.

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Transportable long-lived hyperpolarized samples

S. A. A. Jannin; G. Bodenhausen; L. Emsley

EP3081952 ; US2016306020 ; EP3081952 . 2016.

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Structure of viral nucleocapsid by solid-state NMR at 100 kHz magic-angle spinning

D. Cala-De Paepe; K. Jaudzems; L. B. Andreas; J. Stanek; D. Lalli  et al.

2016. 41st FEBS Congress on Molecular and Systems Biology for a Better Life, Kusadasi, TURKEY, SEP 03-08, 2016. p. 32-32.

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Molecular Level Characterization of the Structure and Interactions in Peptide-Functionalized Metal-Organic Frameworks

T. K. Todorova; X. Rozanska; C. Gervais; A. Legrand; L. N. Ho  et al.

Chemistry-A European Journal. 2016. DOI : 10.1002/chem.201603255.

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Microwave-gated dynamic nuclear polarization

A. Bornet; A. Pinon; A. Jhajharia; M. Baudin; X. Ji  et al.

Physical Chemistry Chemical Physics. 2016. DOI : 10.1039/c6cp05587g.

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Cl-35 dynamic nuclear polarization solid-state NMR of active pharmaceutical ingredients

D. A. Hirsh; A. J. Rossini; L. Emsley; R. W. Schurko

Physical Chemistry Chemical Physics. 2016. DOI : 10.1039/c6cp04353d.

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Cubic three-dimensional hybrid silica solids for nuclear hyperpolarization

D. Baudouin; H. A. Van Kalkeren; A. Bornet; B. Vuichoud; L. Veyre  et al.

Chemical Science. 2016. DOI : 10.1039/c6sc02055k.

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Structure of fully protonated proteins by proton-detected magic-angle spinning NMR

L. B. Andreas; K. Jaudzems; J. Stanek; D. Lalli; A. Bertarello  et al.

Proceedings Of The National Academy Of Sciences Of The United States Of America. 2016. DOI : 10.1073/pnas.1602248113.

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Hyperpolarization of Frozen Hydrocarbon Gases by Dynamic Nuclear Polarization at 1.2 K

B. Vuichoud; E. Canet; J. Milani; A. Bornet; D. Baudouin  et al.

Journal Of Physical Chemistry Letters. 2016. DOI : 10.1021/acs.jpclett.6b01345.

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Structure elucidation of a complex CO2-based organic framework material by NMR crystallography

J. Leclaire; G. Poisson; F. Ziarelli; G. Pepe; F. Fotiadu  et al.

Chemical Science. 2016. DOI : 10.1039/c5sc03810c.

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Atomic-level organization of vicinal acid-base pairs through the chemisorption of aniline and derivatives onto mesoporous SBA15

B. Hamzaoui; A. Bendjeriou-Sedjerari; E. Pump; E. Abou-Hamad; R. Sougrat  et al.

Chemical Science. 2016. DOI : 10.1039/c6sc01229a.

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Correlating Synthetic Methods, Morphology, Atomic-Level Structure, and Catalytic Activity of Sn-beta Catalysts

P. Wolf; M. Valla; F. Nunez-Zarur; A. Comas-Vives; A. J. Rossini  et al.

Acs Catalysis. 2016. DOI : 10.1021/acscatal.6b00114.

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Long-lived nuclear spin states of magnetically equivalent protons by means of dissolution dynamic nuclear polarization

D. Mammoli / G. Bodenhausen; D. L. Emsley (Dir.)

Lausanne, EPFL, 2016. DOI : 10.5075/epfl-thesis-7132.

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Dynamic nuclear polarization at 40 kHz magic angle spinning

S. R. Chaudhari; P. Berruyer; D. Gajan; C. Reiter; F. Engelke  et al.

Physical Chemistry Chemical Physics. 2016. DOI : 10.1039/c6cp00839a.

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Weak and Transient Protein Interactions Determined by Solid-State NMR

H. R. W. Dannatt; M. Felletti; S. Jehle; Y. Wang; L. Emsley  et al.

Angewandte Chemie-International Edition. 2016. DOI : 10.1002/anie.201511609.

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Monolayer Doping of Silicon through Grafting a Tailored Molecular Phosphorus Precursor onto Oxide-Passivated Silicon Surfaces

T. Alphazan; L. Mathey; M. Schwarzwalder; T.-H. Lin; A. J. Rossini  et al.

Chemistry Of Materials. 2016. DOI : 10.1021/acs.chemmater.5b04291.

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Atomistic Description of Reaction Intermediates for Supported Metathesis Catalysts Enabled by DNP SENS

T.-C. Ong; W.-C. Liao; V. Mougel; D. Gajan; A. Lesage  et al.

Angewandte Chemie-International Edition. 2016. DOI : 10.1002/anie.201510821.

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Rational design of dinitroxide biradicals for efficient cross-effect dynamic nuclear polarization

D. J. Kubicki; G. Casano; M. Schwarzwaelder; S. Abel; C. Sauvee  et al.

Chemical Science. 2016. DOI : 10.1039/c5sc02921j.

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Polymorphs of Theophylline Characterized by DNP Enhanced Solid-State NMR

A. C. Pinon; A. J. Rossini; C. M. Widdifield; D. Gajan; L. Emsley

Molecular Pharmaceutics. 2015. DOI : 10.1021/acs.molpharmaceut.5b00610.

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Structure of Colloidal Quantum Dots from Dynamic Nuclear Polarization Surface Enhanced NMR Spectroscopy

L. Piyeteau; T.-C. Ong; A. J. Rossini; L. Emsley; C. Coperet  et al.

Journal Of The American Chemical Society. 2015. DOI : 10.1021/jacs.5b09248.

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Solid-State Dynamic Nuclear Polarization at 9.4 and 18.8 T from 100 K to Room Temperature

M. Lelli; S. R. Chaudhari; D. Gajan; G. Casano; A. J. Rossini  et al.

Journal Of The American Chemical Society. 2015. DOI : 10.1021/jacs.5b08423.

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A solid-state NMR method to determine domain sizes in multi-component polymer formulations

J. Schlagnitweit; M. Tang; M. Baias; S. Richardson; S. Schantz  et al.

Journal Of Magnetic Resonance. 2015. DOI : 10.1016/j.jmr.2015.09.014.

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Structure and Mechanism of the Influenza A M2(18-60) Dimer of Dimers

L. B. Andreas; M. Reese; M. T. Eddy; V. Gelev; Q. Z. Ni  et al.

Journal Of The American Chemical Society. 2015. DOI : 10.1021/jacs.5604802.

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High-resolution NMR of hydrogen in organic solids by DNP enhanced natural abundance deuterium spectroscopy

A. J. Rossini; J. Schlagnitweit; A. Lesage; L. Emsley

Journal Of Magnetic Resonance. 2015. DOI : 10.1016/j.jmr.2015.08.020.

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Nanostructure of Materials Determined by Relayed Paramagnetic Relaxation Enhancement

J. Schlagnitweit; M. Tang; M. Baias; S. Richardson; S. Schantz  et al.

Journal Of The American Chemical Society. 2015. DOI : 10.1021/jacs.5b08249.

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Iridium(I)/N-Heterocyclic Carbene Hybrid Materials: Surface Stabilization of Low-Valent Iridium Species for High Catalytic Hydrogenation Performance

I. Romanenko; D. Gajan; R. Sayah; D. Crozet; E. Jeanneau  et al.

Angewandte Chemie-International Edition. 2015. DOI : 10.1002/anie.201505867.

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Cooperative Effect of Monopodal Silica-Supported Niobium Complex Pairs Enhancing Catalytic Cyclic Carbonate Production

V. D'Elia; H. Dong; A. J. Rossini; C. M. Widdifield; S. V. C. Vummaleti  et al.

Journal Of The American Chemical Society. 2015. DOI : 10.1021/jacs.5b02872.

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Influences of Dilute Organic Adsorbates on the Hydration of Low-Surface-Area Silicates

R. P. Sangodkar; B. J. Smith; D. Gajan; A. J. Rossini; L. R. Roberts  et al.

Journal Of The American Chemical Society. 2015. DOI : 10.1021/jacs.5b00622.

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Protein residue linking in a single spectrum for magic-angle spinning NMR assignment

L. B. Andreas; J. Stanek; T. Le Marchand; A. Bertarello; D. C.-D. Paepe  et al.

Journal Of Biomolecular Nmr. 2015. DOI : 10.1007/s10858-015-9956-1.

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Atomic Description of the Interface between Silica and Alumina in Aluminosilicates through Dynamic Nuclear Polarization Surface-Enhanced NMR Spectroscopy and First-Principles Calculations

M. Valla; A. J. Rossini; M. Caillot; C. Chizallet; P. Raybaud  et al.

Journal Of The American Chemical Society. 2015. DOI : 10.1021/jacs.5b06134.

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Alkane Metathesis with the Tantalum Methylidene [( SiO)Ta(=CH2)Me-2]/[( SiO)(2)Ta(=CH2)Me] Generated from Well-Defined Surface Organometallic Complex [( SiO)(TaMe4)-Me-V]

Y. Chen; E. Abou-Hamad; A. Hamieh; B. Hamzaoui; L. Emsley  et al.

Journal of the American Chemical Society. 2015. DOI : 10.1021/ja5113468.

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Atomistic Description of Thiostannate-Capped CdSe Nanocrystals: Retention of Four-Coordinate SnS4 Motif and Preservation of Cd-Rich Stoichiometry

L. Protesescu; M. Nachtegaal; O. Voznyy; O. Borovinskaya; A. J. Rossini  et al.

Journal of the American Chemical Society. 2015. DOI : 10.1021/ja510862c.

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Lipid bilayer-bound conformation of an integral membrane beta barrel protein by multidimensional MAS NMR

M. T. Eddy; Y. Su; R. Silvers; L. Andreas; L. Clark  et al.

Journal of Biomolecular NMR. 2015. DOI : 10.1007/s10858-015-9903-1.

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Macroscopic nuclear spin diffusion constants of rotating polycrystalline solids from first-principles simulation

M. E. Halse; A. Zagdoun; J.-N. Dumez; L. Emsley

Journal of Magnetic Resonance. 2015. DOI : 10.1016/j.jmr.2015.02.016.

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Superstructure of a Substituted Zeolitic Imidazolate Metal-Organic Framework Determined by Combining Proton Solid-State NMR Spectroscopy and DFT Calculations

M. Baias; A. Lesage; S. Aguado; J. Canivet; V. Moizan-Basle  et al.

Angewandte Chemie International Edition. 2015. DOI : 10.1002/anie.201500518.

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De l'usage des protons hyperpolarisés pour augmenter la sensibilité de la RMN

A. Bornet / G. Bodenhausen; S. Jannin (Dir.)

Lausanne, EPFL, 2015. DOI : 10.5075/epfl-thesis-6581.

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Direct observation of hierarchical protein dynamics

J. R. Lewandowski; M. E. Halse; M. Blackledge; L. Emsley

Science. 2015. DOI : 10.1126/science.aaa6111.

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Sensitivity and resolution of proton detected spectra of a deuterated protein at 40 and 60 kHz magic-angle-spinning

A. J. Nieuwkoop; W. T. Franks; K. Rehbein; A. Diehl; U. Akbey  et al.

Journal Of Biomolecular Nmr. 2015. DOI : 10.1007/s10858-015-9904-0.

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Sn surface-enriched Pt–Sn bimetallic nanoparticles as a selective and stable catalyst for propane dehydrogenation

H. Zhu; D. H. Anjum; Q. Wang; E. Abou-Hamad; L. Emsley  et al.

Journal of Catalysis. 2014. DOI : 10.1016/j.jcat.2014.09.013.

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Dynamic nuclear polarisation enhanced N-14 overtone MAS NMR spectroscopy

A. J. Rossini; L. Emsley; L. A. O'Dell

Physical Chemistry Chemical Physics. 2014. DOI : 10.1039/c4cp00590b.

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Well-defined mono(eta(3)-allyl)nickel complex MONi(eta(3)-C3H5) (M = Si or Al) grafted onto silica or alumina: a molecularly dispersed nickel precursor for syntheses of supported small size nickel nanoparticles

L. Li; E. Abou-Hamad; D. H. Anjum; L. Zhou; P. V. Laveille  et al.

Chemical Communications. 2014. DOI : 10.1039/c4cc02962c.

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Hydrophobic radicals embedded in neutral surfactants for dynamic nuclear polarization of aqueous environments at 9.4 Tesla

M. Lelli; A. J. Rossini; G. Casano; O. Ouari; P. Tordo  et al.

Chemical Communications. 2014. DOI : 10.1039/c4cc02152e.

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WMe6 Tamed by Silica: Si-O-WMe5 as an Efficient, Well-Defined Species for Alkane Metathesis, Leading to the Observation of a Supported W-Methyl/Methylidyne Species

M. K. Samantaray; E. Callens; E. Abou-Hamad; A. J. Rossini; C. M. Widdifield  et al.

Journal of the American Chemical Society. 2014. DOI : 10.1021/ja410747g.

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Homonuclear Decoupling of H-1 Dipolar Interactions in Solids by means of Heteronuclear Recoupling

G. L. Olsen; A. Lupulescu; J.-N. Dumez; L. Emsley; L. Frydman

ISRAEL JOURNAL OF CHEMISTRY. 2014. DOI : 10.1002/ijch.201300102.

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High-Resolution H-1 Solid-State NMR Spectroscopy Using Windowed LG4 Homonuclear Dipolar Decoupling

M. E. Halse; J. Schlagnitweit; L. Emsley

ISRAEL JOURNAL OF CHEMISTRY. 2014. DOI : 10.1002/ijch.201300101.

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Dynamic Nuclear Polarization Enhanced NMR Spectroscopy for Pharmaceutical Formulations

A. J. Rossini; C. M. Widdifield; A. Zagdoun; M. Lelli; M. Schwarzwaelder  et al.

Journal of the American Chemical Society. 2014. DOI : 10.1021/ja4092038.

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Unraveling the Core-Shell Structure of Ligand-Capped Sn/SnOx Nanoparticles by Surface-Enhanced Nuclear Magnetic Resonance, Mossbauer, and X-ray Absorption Spectroscopies

L. Protesescu; A. J. Rossini; D. Kriegner; M. Valla; A. de Kergommeaux  et al.

ACS NANO. 2014. DOI : 10.1021/nn406344n.

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Metabolic expressivity of human genetic variants: NMR metabotyping of MEN1 pathogenic mutants

B. J. Blaise; C. Lopez; C. Vercherat; A. Lacheretz-Bernigaud; M. Bayet-Robert  et al.

JOURNAL OF PHARMACEUTICAL AND BIOMEDICAL ANALYSIS. 2014. DOI : 10.1016/j.jpba.2013.09.029.

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Heteronuclear proton double quantum-carbon single quantum scalar correlation in solids

Y. J. Reddy; V. Agarwal; A. Lesage; L. Emsley; K. V. Ramanathan

Journal of Magnetic Resonance. 2014. DOI : 10.1016/j.jmr.2014.05.004.

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Characterising local environments in high energy density Li-ion battery cathodes: a combined NMR and first principles study of LiFexCo1-xPO4

F. C. Strobridge; D. S. Middlemiss; A. J. Pell; M. Leskes; R. J. Clement  et al.

JOURNAL OF MATERIALS CHEMISTRY A. 2014. DOI : 10.1039/c4ta00934g.

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Insights into the Structure and Dynamics of Measles Virus Nucleocapsids by H-1-detected Solid-state NMR

E. Barbet-Massin; M. Felletti; R. Schneider; S. Jehle; G. Communie  et al.

BIOPHYSICAL JOURNAL. 2014. DOI : 10.1016/j.bpj.2014.05.048.

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Rapid Proton-Detected NMR Assignment for Proteins with Fast Magic Angle Spinning

E. Barbet-Massin; A. J. Pell; J. S. Retel; L. B. Andreas; K. Jaudzems  et al.

Journal of the American Chemical Society. 2014. DOI : 10.1021/ja507382j.

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Silica-surface reorganization during organotin grafting evidenced by Sn-119 DNP SENS: a tandem reaction of gem-silanols and strained siloxane bridges

M. P. Conley; A. J. Rossini; A. Comas-Vives; M. Valla; G. Casano  et al.

Physical Chemistry Chemical Physics. 2014. DOI : 10.1039/c4cp01973c.

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NMR Signatures of the Active Sites in Sn-beta Zeolite

P. Wolf; M. Valla; A. J. Rossini; A. Comas-Vives; F. Nunez-Zarur  et al.

Angewandte Chemie-International Edition. 2014. DOI : 10.1002/anie.201403905.

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Amplifying Dynamic Nuclear Polarization of Frozen Solutions by Incorporating Dielectric Particles

D. J. Kubicki; A. J. Rossini; A. Purea; A. Zagdoun; O. Ouari  et al.

Journal Of The American Chemical Society. 2014. DOI : 10.1021/ja5088453.

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Hybrid polarizing solids for pure hyperpolarized liquids through dissolution dynamic nuclear polarization

D. Gajan; A. Bornet; B. Vuichoud; J. Milani; R. Melzi  et al.

Proceedings Of The National Academy Of Sciences Of The United States Of America. 2014. DOI : 10.1073/pnas.1407730111.

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Improved Dynamic Nuclear Polarization Surface-Enhanced NMR Spectroscopy through Controlled Incorporation of Deuterated Functional Groups

A. Zagdoun; A. J. Rossini; M. P. Conley; W. R. Gruening; M. Schwarzwaelder  et al.

Angewandte Chemie-International Edition. 2013. DOI : 10.1002/anie.201208699.

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Powder crystallography of pharmaceutical materials by combined crystal structure prediction and solid-state H-1 NMR spectroscopy

M. Baias; C. M. Widdifield; J.-N. Dumez; H. P. G. Thompson; T. G. Cooper  et al.

Physical Chemistry Chemical Physics. 2013. DOI : 10.1039/c3cp41095a.

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Molecular-level characterization of the structure and the surface chemistry of periodic mesoporous organosilicates using DNP-surface enhanced NMR spectroscopy

W. R. Gruening; A. J. Rossini; A. Zagdoun; D. Gajan; A. Lesage  et al.

Physical Chemistry Chemical Physics. 2013. DOI : 10.1039/c3cp00026e.

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Methane Reacts with Heteropolyacids Chemisorbed on Silica to Produce Acetic Acid under Soft Conditions

M. Sun; E. Abou-Hamad; A. J. Rossini; J. Zhang; A. Lesage  et al.

Journal of the American Chemical Society. 2013. DOI : 10.1021/ja309966j.

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Evidence for Metal-Surface Interactions and Their Role in Stabilizing Well-Defined Immobilized Ru-NHC Alkene Metathesis Catalysts

M. K. Samantaray; J. Alauzun; D. Gajan; S. Kavitake; A. Mehdi  et al.

Journal of the American Chemical Society. 2013. DOI : 10.1021/ja311722k.

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Frequency-stepped acquisition in nuclear magnetic resonance spectroscopy under magic angle spinning

A. J. Pell; R. J. Clement; C. P. Grey; L. Emsley; G. Pintacuda

Journal of Chemical Physics. 2013. DOI : 10.1063/1.4795001.

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Protein structure and dynamics from paramagnetic and diamagnetic relaxation in solids

L. Emsley

2013.

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Dynamic nuclear polarization surface enhanced NMR spectroscopy for atomic-level characterisation of materials surfaces

L. Emsley

2013.

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Advances in Magnetic Resonance: From Stem Cells to Catalytic Surfaces

L. Emsley

Journal of the American Chemical Society. 2013. DOI : 10.1021/ja404269a.

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Improved Phase-Modulated Homonuclear Dipolar Decoupling for Solid-State NMR Spectroscopy from Symmetry Considerations

M. E. Halse; L. Emsley

JOURNAL OF PHYSICAL CHEMISTRY A. 2013. DOI : 10.1021/jp4038733.

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Out-and-back C-13-C-13 scalar transfers in protein resonance assignment by proton-detected solid-state NMR under ultra-fast MAS

E. Barbet-Massin; A. J. Pell; K. Jaudzems; W. T. Franks; J. S. Retel  et al.

JOURNAL OF BIOMOLECULAR NMR. 2013. DOI : 10.1007/s10858-013-9757-3.

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Large Molecular Weight Nitroxide Biradicals Providing Efficient Dynamic Nuclear Polarization at Temperatures up to 200 K

A. Zagdoun; G. Casano; O. Ouari; M. Schwaerzwalder; A. J. Rossini  et al.

Journal of the American Chemical Society. 2013. DOI : 10.1021/ja405813t.

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A Well-Defined Pd Hybrid Material for the Z-Selective Semihydrogenation of Alkynes Characterized at the Molecular Level by DNP SENS

M. P. Conley; R. M. Drost; M. Baffert; D. Gajan; C. Elsevier  et al.

Chemistry-A European Journal. 2013. DOI : 10.1002/chem.201302484.

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C-13-Detected Through-Bond Correlation Experiments for Protein Resonance Assignment by Ultra-Fast MAS Solid-State NMR

E. Barbet-Massin; A. J. Pell; M. J. Knight; A. L. Webber; I. C. Felli  et al.

CHEMPHYSCHEM. 2013. DOI : 10.1002/cphc.201201097.

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Magic Angle Spinning NMR of Paramagnetic Proteins

M. J. Knight; I. C. Felli; R. Pierattelli; L. Emsley; G. Pintacuda

ACCOUNTS OF CHEMICAL RESEARCH. 2013. DOI : 10.1021/ar300349y.

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Dynamic Nuclear Polarization Surface Enhanced NMR Spectroscopy

A. J. Rossini; A. Zagdoun; M. Lelli; A. Lesage; C. Coperet  et al.

ACCOUNTS OF CHEMICAL RESEARCH. 2013. DOI : 10.1021/ar300322x.

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Frontiers in Solid-State NMR Technology

L. Emsley; I. Bertini

ACCOUNTS OF CHEMICAL RESEARCH. 2013. DOI : 10.1021/ar4001718.

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Solid-Phase Polarization Matrixes for Dynamic Nuclear Polarization from Homogeneously Distributed Radicals in Mesostructured Hybrid Silica Materials

D. Gajan; M. Schwarzwaelder; M. P. Conley; W. R. Gruening; A. J. Rossini  et al.

Journal of the American Chemical Society. 2013. DOI : 10.1021/ja405822h.

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De Novo Determination of the Crystal Structure of a Large Drug Molecule by Crystal Structure Prediction-Based Powder NMR Crystallography

M. Baias; J.-N. Dumez; P. H. Svensson; S. Schantz; G. M. Day  et al.

Journal of the American Chemical Society. 2013. DOI : 10.1021/ja4088874.

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Bipodal Surface Organometallic Complexes with Surface N-Donor Ligands and Application to the Catalytic Cleavage of C-H and C-C Bonds in n-Butane

A. Bendjeriou-Sedjerari; J. M. Azzi; E. Abou-Hamad; D. H. Anjum; F. A. Pasha  et al.

Journal of the American Chemical Society. 2013. DOI : 10.1021/ja407902g.

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A Well-Defined Silica-Supported Tungsten Oxo Alkylidene Is a Highly Active Alkene Metathesis Catalyst

M. P. Conley; V. Mougel; D. V. Peryshkov; W. P. J. Forrest; D. Gajan  et al.

Journal of the American Chemical Society. 2013. DOI : 10.1021/ja410052u.

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A first-principles description of proton-driven spin diffusion

J.-N. Dumez; M. E. Halse; M. C. Butler; L. Emsley

Physical Chemistry Chemical Physics. 2012. DOI : 10.1039/c1cp22662b.

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One hundred fold overall sensitivity enhancements for Silicon-29 NMR spectroscopy of surfaces by dynamic nuclear polarization with CPMG acquisition

A. J. Rossini; A. Zagdoun; M. Lelli; D. Gajan; F. Rascon  et al.

CHEMICAL SCIENCE. 2012. DOI : 10.1039/c1sc00550b.

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Non-aqueous solvents for DNP surface enhanced NMR spectroscopy

A. Zagdoun; A. J. Rossini; D. Gajan; A. Bourdolle; O. Ouari  et al.

Chemical Communications. 2012. DOI : 10.1039/c1cc15242d.

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Dynamic Nuclear Polarization Enhanced Solid-State NMR Spectroscopy of Functionalized Metal-Organic Frameworks

A. J. Rossini; A. Zagdoun; M. Lelli; J. Canivet; S. Aguado  et al.

Angewandte Chemie-International Edition. 2012. DOI : 10.1002/anie.201106030.

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A well-defined mesoporous amine silica surface via a selective treatment of SBA-15 with ammonia

A. Bendjeriou-Sedjerari; J. D. A. Pelletier; E. Abou-hamad; L. Emsley; J.-M. Basset

Chemical Communications. 2012. DOI : 10.1039/c2cc00143h.

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A common theory for phase-modulated homonuclear decoupling in solid-state NMR

M. E. Halse; L. Emsley

Physical Chemistry Chemical Physics. 2012. DOI : 10.1039/c2cp40720e.

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Backbone Assignment of Fully Protonated Solid Proteins by 1H Detection and Ultrafast Magic-Angle-Spinning NMR Spectroscopy

A. Marchetti; S. Jehle; M. Felletti; M. J. Knight; Y. Wang  et al.

Angewandte Chemie-International Edition. 2012. DOI : 10.1002/anie.201203124.

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A Slowly Relaxing Rigid Biradical for Efficient Dynamic Nuclear Polarization Surface-Enhanced NMR Spectroscopy: Expeditious Characterization of Functional Group Manipulation in Hybrid Materials

A. Zagdoun; G. Casano; O. Ouari; G. Lapadula; A. J. Rossini  et al.

Journal of the American Chemical Society. 2012. DOI : 10.1021/ja210177v.

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The RMN in a high field Sixty years revolutionizing science

A. Zagdoun; L. Emsley

L'Actualité Chimique. 2012.

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The RMN: an ever-evolving tool at the service of all aspects of chemistry

L. Emsley; S. Caldarelli; J.-N. Dumez

L'Actualité Chimique. 2012.

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Quasi-equilibria in reduced Liouville spaces

M. E. Halse; J.-N. Dumez; L. Emsley

Journal of Chemical Physics. 2012. DOI : 10.1063/1.4726162.

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Combination of DQ and ZQ Coherences for Sensitive Through-Bond NMR Correlation Experiments in Biosolids under Ultra-Fast MAS

A. L. Webber; A. J. Pell; E. Barbet-Massin; M. J. Knight; I. Bertini  et al.

CHEMPHYSCHEM. 2012. DOI : 10.1002/cphc.201200099.

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Structure and backbone dynamics of a microcrystalline metalloprotein by solid-state NMR

M. J. Knight; A. J. Pell; I. Bertini; I. C. Felli; L. Gonnelli  et al.

Proceedings of the National Academy of Sciences of the United States of America. 2012. DOI : 10.1073/pnas.1204515109.

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Ultra fast MAS solid-state NMR studies of protein-protein interactions in the bacterial replisome

M. Felletti; S. Jehle; Y. Wang; K. Ozawa; S. Jergic  et al.

FEBS Journal. 2012.

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Rapid Measurement of Pseudocontact Shifts in Metalloproteins by Proton-Detected Solid-State NMR Spectroscopy

M. J. Knight; I. C. Felli; R. Pierattelli; I. Bertini; L. Emsley  et al.

Journal of the American Chemical Society. 2012. DOI : 10.1021/ja306813j.

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Dynamic Nuclear Polarization NMR Spectroscopy of Microcrystalline Solids

A. J. Rossini; A. Zagdoun; F. Hegner; M. Schwarzwalder; D. Gajan  et al.

Journal of the American Chemical Society. 2012. DOI : 10.1021/ja308135r.

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Spin-Transfer Pathways in Paramagnetic Lithium Transition-Metal Phosphates from Combined Broadband Isotropic Solid-State MAS NMR Spectroscopy and DFT Calculations

R. J. Clement; A. J. Pell; D. S. Middlemiss; F. C. Strobridge; J. K. Miller  et al.

Journal of the American Chemical Society. 2012. DOI : 10.1021/ja306876u.

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A Silica-Supported Double-Decker Silsesquioxane Provides a Second Skin for the Selective Generation of Bipodal Surface Organometallic Complexes

J. Espinas; J. D. A. Pelletier; E. Abou-Hamad; L. Emsley; J.-M. Basset

Organometallics. 2012. DOI : 10.1021/om300918v.

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Atomic-Resolution Structural Dynamics in Crystalline Proteins from NMR and Molecular Simulation

L. Mollica; M. Baias; J. R. Lewandowski; B. J. Wylie; L. J. Sperling  et al.

JOURNAL OF PHYSICAL CHEMISTRY LETTERS. 2012. DOI : 10.1021/jz3016233.

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Dynamic nuclear polarization of quadrupolar nuclei using cross polarization from protons: surface-enhanced aluminium-27 NMR

V. Vitzthum; P. Mieville; D. Carnevale; M. A. Caporini; D. Gajan  et al.

Chemical Communications. 2012. DOI : 10.1039/c2cc15905h.

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A master-equation approach to the description of proton-driven spin diffusion from crystal geometry using simulated zero-quantum lineshapes

J.-N. Dumez; L. Emsley

Physical Chemistry Chemical Physics. 2011. DOI : 10.1039/c1cp00004g.

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A highly ordered mesostructured material containing regularly distributed phenols: preparation and characterization at a molecular level through ultra-fast magic angle spinning proton NMR spectroscopy

A. Roussey; D. Gajan; T. K. Maishal; A. Mukerjee; L. Veyre  et al.

Physical Chemistry Chemical Physics. 2011. DOI : 10.1039/c0cp02137g.

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Probing surface site heterogeneity through 1D and INADEQUATE P-31 solid state NMR spectroscopy of silica supported PMe3-Au(I) adducts

D. Gajan; D. Levine; E. Zocher; C. Coperet; A. Lesage  et al.

CHEMICAL SCIENCE. 2011. DOI : 10.1039/c0sc00579g.

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High-resolution and sensitivity through-bond correlations in ultra-fast magic angle spinning (MAS) solid-state NMR

I. Bertini; L. Emsley; I. C. Felli; S. Laage; A. Lesage  et al.

CHEMICAL SCIENCE. 2011. DOI : 10.1039/c0sc00397b.

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Fast Resonance Assignment and Fold Determination of Human Superoxide Dismutase by High-Resolution Proton-Detected Solid-State MAS NMR Spectroscopy

M. J. Knight; A. L. Webber; A. J. Pell; P. Guerry; E. Barbet-Massin  et al.

Angewandte Chemie-International Edition. 2011. DOI : 10.1002/anie.201106340.

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Broadband inversion for MAS NMR with single-sideband-selective adiabatic pulses

A. J. Pell; G. Kervern; L. Emsley; M. Deschamps; D. Massiot  et al.

Journal of Chemical Physics. 2011. DOI : 10.1063/1.3521491.

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Assessing the EPIC blood sample bio-bank for NMR-based metabolomics

C. Pontoizeau; B. Elena-Herrmann; B. Blaise; S. Rinaldi; G. Byrnes  et al.

Bulletin Du Cancer. 2011.

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H-1 NMR-based metabolomics reveals a serum metabolic signature of advanced metastatic breast cancer

E. Jobard; C. Pontoizeau; B. Blaise; P. Toulhoat; L. Emsley  et al.

Bulletin Du Cancer. 2011.

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Broad-Ranging Natural Metabotype Variation Drives Physiological Plasticity in Healthy Control Inbred Rat Strains

C. Pontoizeau; J. F. Fearnside; V. Nayratil; C. Domange; J.-B. Cazier  et al.

JOURNAL OF PROTEOME RESEARCH. 2011. DOI : 10.1021/pr101000z.

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Orthogonal Filtered Recoupled-STOCSY to Extract Metabolic Networks Associated with Minor Perturbations from NMR Spectroscopy

B. J. Blaise; V. Navratil; L. Emsley; P. Toulhoat

JOURNAL OF PROTEOME RESEARCH. 2011. DOI : 10.1021/pr200489n.

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Enhanced Resolution and Coherence Lifetimes in the Solid-State NMR Spectroscopy of Perdeuterated Proteins under Ultrafast Magic-Angle Spinning

J. R. Lewandowski; J.-N. Dumez; U. Akbey; S. Lange; L. Emsley  et al.

JOURNAL OF PHYSICAL CHEMISTRY LETTERS. 2011. DOI : 10.1021/jz200844n.

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A scaling factor theorem for homonuclear dipolar decoupling in solid-state NMR spectroscopy

E. Salager; J.-N. Dumez; L. Emsley; M. H. Levitt

Journal of Magnetic Resonance. 2011. DOI : 10.1016/j.jmr.2011.05.017.

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Single crystal nuclear magnetic resonance in spinning powders

A. J. Pell; G. Pintacuda; L. Emsley

Journal of Chemical Physics. 2011. DOI : 10.1063/1.3640418.

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Site-Specific Measurement of Slow Motions in Proteins

J. R. Lewandowski; H. J. Sass; S. Grzesiek; M. Blackledge; L. Emsley

Journal of the American Chemical Society. 2011. DOI : 10.1021/ja206815h.

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Fast Characterization of Functionalized Silica Materials by Silicon-29 Surface-Enhanced NMR Spectroscopy Using Dynamic Nuclear Polarization

M. Lelli; D. Gajan; A. Lesage; M. A. Caporini; V. Vitzthum  et al.

Journal Of The American Chemical Society. 2011. DOI : 10.1021/ja110791d.

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Ab initio simulation of proton spin diffusion

J.-N. Dumez; M. C. Butler; E. Salager; B. Elena-Herrmann; L. Emsley

Physical Chemistry Chemical Physics. 2010. DOI : 10.1039/c0cp00050g.

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Complete H-1 resonance assignment of beta-maltose from H-1-H-1 DQ-SQ CRAMPS and H-1 (DQ-DUMBO)-C-13 SQ refocused INEPT 2D solid-state NMR spectra and first principles GIPAW calculations

A. L. Webber; B. Elena; J. M. Griffin; J. R. Yates; T. N. Pham  et al.

Physical Chemistry Chemical Physics. 2010. DOI : 10.1039/c001290d.

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Synthesis and reactivity of molybdenum imido alkylidene bis-pyrazolide complexes

D. Gajan; N. Rendon; K. M. Wampler; J.-M. Basset; C. Coperet  et al.

Dalton Transactions. 2010. DOI : 10.1039/c0dt00315h.

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Anisotropic Collective Motion Contributes to Nuclear Spin Relaxation in Crystalline Proteins

J. R. Lewandowski; J. Sein; M. Blackledge; L. Emsley

Journal of the American Chemical Society. 2010. DOI : 10.1021/ja907067j.

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Assessment of pathogenic mutations in cancer syndromes by NMR based metabonomics

B. Blaise; C. Vercherat; V. Navratil; A. Lacheretz-Bernigaud; M. Piotto  et al.

Bulletin Du Cancer. 2010.

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Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution H-1 Solid-State NMR Spectroscopy

E. Salager; G. M. Day; R. S. Stein; C. J. Pickard; B. Elena  et al.

Journal of the American Chemical Society. 2010. DOI : 10.1021/ja909449k.

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A Multitechnique Approach to Spin-Flips for Cp2Cr(II) Chemistry in Confined State

J. Estephane; E. Groppo; J. G. Vitillo; A. Damin; D. Gianolio  et al.

JOURNAL OF PHYSICAL CHEMISTRY C. 2010. DOI : 10.1021/jp907986w.

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Ultrafast MAS Solid-State NMR Permits Extensive C-13 and H-1 Detection in Paramagnetic Metalloproteins

I. Bertini; L. Emsley; M. Lelli; C. Luchinat; J. Mao  et al.

Journal of the American Chemical Society. 2010. DOI : 10.1021/ja100398q.

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Fibrillar vs Crystalline Full-Length beta-2-Microglobulin Studied by High-Resolution Solid-State NMR Spectroscopy

E. Barbet-Massin; S. Ricagno; J. R. Lewandowski; S. Giorgetti; V. Bellotti  et al.

Journal of the American Chemical Society. 2010. DOI : 10.1021/ja1002839.

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Measurement of Site-Specific C-13 Spin-Lattice Relaxation in a Crystalline Protein

J. R. Lewandowski; J. Sein; H. J. Sass; S. Grzesiek; M. Blackledge  et al.

Journal of the American Chemical Society. 2010. DOI : 10.1021/ja102744b.

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Targeted projection NMR spectroscopy for unambiguous metabolic profiling of complex mixtures

C. Pontoizeau; T. Herrmann; P. Toulhoat; B. Elena-Herrmann; L. Emsley

MAGNETIC RESONANCE IN CHEMISTRY. 2010. DOI : 10.1002/mrc.2661.

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Two-Dimensional Statistical Recoup ling for the Identification of Perturbed Metabolic Networks from NMR Spectroscopy

B. J. Blaise; V. Navratil; C. Domange; L. Shintu; M.-E. Dumas  et al.

JOURNAL OF PROTEOME RESEARCH. 2010. DOI : 10.1021/pr1002615.

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NMR Crystallography of Campho[2,3-c]pyrazole (Z `=6): Combining High-Resolution H-1-C-13 Solid-State MAS NMR Spectroscopy and GIPAW Chemical-Shift Calculations

A. L. Webber; L. Emsley; R. M. Claramunt; S. P. Brown

JOURNAL OF PHYSICAL CHEMISTRY A. 2010. DOI : 10.1021/jp104901j.

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Homonuclear dipolar decoupling with very large scaling factors for high-resolution ultrafast magic angle spinning H-1 solid-state NMR spectroscopy

E. Salager; J.-N. Dumez; R. S. Stein; S. Steuernagel; A. Lesage  et al.

Chemical Physics Letters. 2010. DOI : 10.1016/j.cplett.2010.08.038.

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Computation and NMR crystallography of terbutaline sulfate

R. K. Harris; P. Hodgkinson; V. Zorin; J.-N. Dumez; B. Elena-Herrmann  et al.

MAGNETIC RESONANCE IN CHEMISTRY. 2010. DOI : 10.1002/mrc.2636.

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Numerical simulation of free evolution in solid-state nuclear magnetic resonance using low-order correlations in Liouville space

J.-N. Dumez; M. C. Butler; L. Emsley

Journal of Chemical Physics. 2010. DOI : 10.1063/1.3505455.

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Surface Enhanced NMR Spectroscopy by Dynamic Nuclear Polarization

A. Lesage; M. Lelli; D. B. R. A. Gajan; M. A. Caporini; V. Vitzthum  et al.

Journal of the American Chemical Society. 2010. DOI : 10.1021/ja104771z.

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Motional heterogeneity in single-site silica-supported species revealed by deuteron NMR

J. Gath; G. L. Hoaston; R. L. Vold; R. Berthoud; C. Coperet  et al.

Physical Chemistry Chemical Physics. 2009. DOI : 10.1039/b907665d.

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Well-Defined Silica-Supported Mo-Alkylidene Catalyst Precursors Containing One OR Substituent: Methods of Preparation and Structure-Reactivity Relationship in Alkene Metathesis

N. Rendon; R. Berthoud; F. Blanc; D. Gajan; T. Maishal  et al.

Chemistry-A European Journal. 2009. DOI : 10.1002/chem.200802465.

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Crystal-Structure Determination of Powdered Paramagnetic Lanthanide Complexes by Proton NMR Spectroscopy

G. Kervern; A. D'Aleo; L. Toupet; O. Maury; L. Emsley  et al.

Angewandte Chemie-International Edition. 2009. DOI : 10.1002/anie.200805302.

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Fast acquisition of multi-dimensional spectra in solid-state NMR enabled by ultra-fast MAS

S. Laage; J. R. Sachleben; S. Steuernagel; R. Pierattelli; G. Pintacuda  et al.

Journal of Magnetic Resonance. 2009. DOI : 10.1016/j.jmr.2008.10.019.

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Characterizing Slight Structural Disorder in Solids by Combined Solid-State NMR and First Principles Calculations

S. Cadars; A. Lesage; C. J. Pickard; P. Sautet; L. Emsley

JOURNAL OF PHYSICAL CHEMISTRY A. 2009. DOI : 10.1021/jp810138y.

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Enhanced sensitivity in high-resolution H-1 solid-state NMR spectroscopy with DUMBO dipolar decoupling under ultra-fast MAS

E. Salager; R. S. Stein; S. Steuernagel; A. Lesage; B. Elena  et al.

Chemical Physics Letters. 2009. DOI : 10.1016/j.cplett.2008.12.073.

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Powder NMR crystallography of thymol

E. Salager; R. S. Stein; C. J. Pickard; B. Elena; L. Emsley

Physical Chemistry Chemical Physics. 2009. DOI : 10.1039/b821018g.

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Metabolic Profiling Strategy of Caenorhabditis elegans by Whole-Organism Nuclear Magnetic Resonance

B. J. Blaise; J. Giacomotto; M. N. Triba; P. Toulhoat; M. Piotto  et al.

JOURNAL OF PROTEOME RESEARCH. 2009. DOI : 10.1021/pr900012d.

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Statistical Recoupling Prior to Significance Testing in Nuclear Magnetic Resonance Based Metabonomics

B. J. Blaise; L. Shintu; B. Elena; L. Emsley; M.-E. Dumas  et al.

ANALYTICAL CHEMISTRY. 2009. DOI : 10.1021/ac9007754.

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Dynamics of large nuclear-spin systems from low-order correlations in Liouville space

M. C. Butler; J.-N. Dumez; L. Emsley

Chemical Physics Letters. 2009. DOI : 10.1016/j.cplett.2009.07.017.

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Transverse-Dephasing Optimized Homonuclear J-Decoupling in Solid-State NMR Spectroscopy of Uniformly C-13-Labeled Proteins

S. Laage; A. Lesage; L. Emsley; I. Bertini; I. C. Felli  et al.

Journal of the American Chemical Society. 2009. DOI : 10.1021/ja903542h.

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CATL 37-Gold nanoparticles supported on passivated silica: Access to the intrinsic oxidation activity of gold

D. Gajan; K. Guillois; P. Delichere; J.-M. Basset; J.-P. Candy  et al.

2009.

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Gold Nanoparticles Supported on Passivated Silica: Access to an Efficient Aerobic Epoxidation Catalyst and the Intrinsic Oxidation Activity of Gold

D. Gajan; K. Guillois; P. Delichere; J.-M. Basset; J.-P. Candy  et al.

Journal of the American Chemical Society. 2009. DOI : 10.1021/ja903730q.

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Characterization of different water pools in solid-state NMR protein samples

A. Boeckmann; C. Gardiennet; R. Verel; A. Hunkeler; A. Loquet  et al.

JOURNAL OF BIOMOLECULAR NMR. 2009. DOI : 10.1007/s10858-009-9374-3.

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High resolution solid state NMR spectroscopy in surface organometallic chemistry: access to molecular understanding of active sites of well-defined heterogeneous catalysts

F. Blanc; C. Coperet; A. Lesage; L. Emsley

CHEMICAL SOCIETY REVIEWS. 2008. DOI : 10.1039/b612793m.

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Polarization transfer over the water-protein interface in solids

A. Lesage; C. Gardiennet; A. Loquet; R. Verel; G. Pintacuda  et al.

Angewandte Chemie-International Edition. 2008. DOI : 10.1002/anie.200801110.

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Resonator with reduced sample heating and increased homogeneity for solid-state NMR

A. Krahn; U. Priller; L. Emsley; F. Engelke

Journal of Magnetic Resonance. 2008. DOI : 10.1016/j.jmr.2007.12.004.

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Dynamics of silica-supported catalysts determined by combining solid-state NMR spectroscopy and DFT calculations

F. Blanc; J.-M. Basset; C. Coperet; A. Sinha; Z. J. Tonzetich  et al.

Journal of the American Chemical Society. 2008. DOI : 10.1021/ja077749v.

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Improving resolution in proton solid-state NMR by removing nitrogen-14 residual dipolar broadening

R. S. Stein; B. Elena; L. Emsley

Chemical Physics Letters. 2008. DOI : 10.1016/j.cplett.2008.05.008.

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Dynamics and disorder in surfactant-templated silicate layers studied by solid-state NMR dephasing times and correlated line shapes

S. Cadars; N. Mifsud; A. Lesage; J. D. Epping; N. Hedin  et al.

JOURNAL OF PHYSICAL CHEMISTRY C. 2008. DOI : 10.1021/jp711398h.

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Methyl proton contacts obtained using heteronuclear through-bond transfers in solid-state NMR spectroscopy

A. Loquet; S. Laage; C. Gardiennet; B. Elena; L. Emsley  et al.

Journal of the American Chemical Society. 2008. DOI : 10.1021/ja801464g.

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INOR 315-Dinitrogen dissociation on an isolated surface tantalum atom (part II)

E. A. Quadrelli; P. Avenier; M. Taoufik; L. Veyre; A. Lesage  et al.

2008.

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INOR 314-Dinitrogen dissociation on an isolated surface tantalum atom (part I): Application of a new concept to prepare highly electron deficient isolated metal atoms

P. Avenier; E. A. Quadrelli; M. Taoufik; A. Lesage; A. Baudouin  et al.

2008.

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Direct observation of reaction intermediates for a well defined heterogeneous alkene metathesis catalyst

F. Blanc; R. Berthoud; C. Coperet; A. Lesage; L. Emsley  et al.

Proceedings of the National Academy of Sciences of the United States of America. 2008. DOI : 10.1073/pnas.0802147105.

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Metabolic profiling of uropathies by 1H-nuclear magnetic resonance Spectroscopy on human amniotic fluid and paediatric urine

C. Pontoizeau; B. Blaise; B. Elena; V. Chambon; P. Toulhoat  et al.

Pediatric Nephrology. 2008.

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Superadiabaticity in magnetic resonance

M. Deschamps; G. Kervern; D. Massiot; G. Pintacuda; L. Emsley  et al.

Journal of Chemical Physics. 2008. DOI : 10.1063/1.3012356.

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Band-Selective H-1-C-13 Cross-Polarization in Fast Magic Angle Spinning Solid-State NMR Spectroscopy

S. Laage; A. Marchetti; J. Sein; R. Pierattelli; H. J. Sass  et al.

Journal of the American Chemical Society. 2008. DOI : 10.1021/ja805926d.

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NMR crystallography of oxybuprocaine hydrochloride, Modification II

R. K. Harris; S. Cadars; L. Emsley; J. R. Yates; C. J. Pickard  et al.

Physical Chemistry Chemical Physics. 2007. DOI : 10.1039/b614318k.

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The influence of nitrogen-15 proton-driven spin diffusion on the measurement of nitrogen-15 longitudinal relaxation times

N. Giraud; M. Blackledge; A. Bockmann; L. Emsley

Journal of Magnetic Resonance. 2007. DOI : 10.1016/j.jmr.2006.09.015.

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Solid-state NMR spectroscopy of a paramagnetic protein: Assignment and study of human dimeric oxidized Cu-II-Zn-II superoxide dismutase (SOD)

G. Pintacuda; N. Giraud; R. Pierattelli; A. Bockmann; I. Bertini  et al.

Angewandte Chemie-International Edition. 2007. DOI : 10.1002/anie.200603093.

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NMR measurements of scalar-coupling distributions in disordered solids

S. Cadars; A. Lesage; M. Trierweiler; L. Heux; L. Emsley

Physical Chemistry Chemical Physics. 2007. DOI : 10.1039/b611096g.

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Well-defined surface imido amido tantalum(V) species from ammonia and silica-supported tantalum hydrides

P. Avenier; A. Lesage; M. Taoufik; A. Baudouin; A. De Mallmann  et al.

Journal of the American Chemical Society. 2007. DOI : 10.1021/ja066809.

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Fast adiabatic pulses for solid-state NMR of paramagnetic systems

G. Kervern; G. Pintacuda; L. Emsley

Chemical Physics Letters. 2007. DOI : 10.1016/j.cplett.2006.12.056.

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The role of N-15 CSA and CSA/dipole cross-correlation in N-15 relaxation in solid proteins

J. Sein; N. Giraud; M. Blackledge; L. Emsley

Journal of Magnetic Resonance. 2007. DOI : 10.1016/j.jmr.2007.01.010.

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Resolving structures from powders by NMR crystallography using combined proton spin diffusion and plane wave DFT calculations

C. J. Pickard; E. Salager; G. Pintacuda; B. Elena; L. Emsley

Journal of the American Chemical Society. 2007. DOI : 10.1021/ja071829h.

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Dinitrogen dissociation on an isolated surface tantalum atom

P. Avenier; M. Taoufik; A. Lesage; X. Solans-Monfort; A. Baudouin  et al.

SCIENCE. 2007. DOI : 10.1126/science.1143078.

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The refocused INADEQUATE MAS NMR experiment in multiple spin-systems: Interpreting observed correlation peaks and optimising lineshapes

S. Cadars; J. Sein; L. Duma; A. Lesage; T. N. Pham  et al.

Journal of Magnetic Resonance. 2007. DOI : 10.1016/j.jmr.2007.05.016.

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Absence of curie relaxation in paramagnetic solids yields long H-1 coherence lifetimes

G. Kervern; S. Steuernagel; F. Engelke; G. Pintacuda; L. Emsley

Journal of the American Chemical Society. 2007. DOI : 10.1021/ja075319z.

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On the orientational dependence of resolution in H-1 solid-state NMR, and its role in MAS, CRAMPS and delayed-acquisition experiments

V. E. Zorin; B. Elena; A. Lesage; L. Emsley; P. Hodgkinson

MAGNETIC RESONANCE IN CHEMISTRY. 2007. DOI : 10.1002/mrc.2108.

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New techniques in solid-state NMR

L. Emsley; L. J. Mueller

MAGNETIC RESONANCE IN CHEMISTRY. 2007. DOI : 10.1002/mrc.2174.

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Metabotyping of Caenorhabditis elegans reveals latent phenotypes

B. J. Blaise; J. Giacomotto; B. Elena; M.-E. Dumas; P. Toullhoat  et al.

Proceedings of the National Academy of Sciences of the United States of America. 2007. DOI : 10.1073/pnas.0707393104.

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Assigning carbon-13 NMR spectra to crystal structures by the INADEQUATE pulse sequence and first principles computation: a case study of two forms of testosterone

R. Harris; S. Joyce; C. Pickard; S. Cadars; L. Emsley

Physical Chemistry Chemical Physics. 2006. DOI : 10.1039/b513392k.

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Surface versus molecular siloxy ligands in well-defined olefin metathesis catalysts: [{(RO)(3)SiO}Mo(=NAr)(=CHtBu)(CH(2)tBu)]

F. Blanc; C. Coperet; J. Thivolle-Cazat; J. Basset; A. Lesage  et al.

Angewandte Chemie-International Edition. 2006. DOI : 10.1002/anie.200503205.

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Floquet-van Vleck analysis of heteronuclear spin decoupling in solids: The effect of spinning and decoupling sidebands on the spectrum

J. Sachleben; J. Gaba; L. Emsley

SOLID STATE NUCLEAR MAGNETIC RESONANCE. 2006. DOI : 10.1016/j.ssnmr.2005.09.009.

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Triple-quantum correlation NMR experiments in solids using J-couplings

F. Fayon; C. Roiland; L. Emsley; D. Massiot

Journal of Magnetic Resonance. 2006. DOI : 10.1016/j.jmr.2005.11.002.

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Accurate measurements of C-13-C-13 J-couplings in the rhodopsin chromophore by double-quantum solid-state NMR spectroscopy

W. Lai; N. McLean; A. Gansmuller; M. Verhoeven; G. Antonioli  et al.

Journal of the American Chemical Society. 2006. DOI : 10.1021/ja0581604.

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Investigation of dipolar-mediated water-protein interactions in microcrystalline Crh by solid-state NMR spectroscopy

A. Lesage; L. Emsley; F. Penin; A. Bockmann

Journal of the American Chemical Society. 2006. DOI : 10.1021/ja060866q.

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Molecular structure determination in powders by NMR crystallography from proton spin diffusion

B. Elena; G. Pintacuda; N. Mifsud; L. Emsley

Journal of the American Chemical Society. 2006. DOI : 10.1021/ja062353p.

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Assigning powders to crystal structures by high-resolution H-1-H-1 double quantum and H-1-C-13 J-INEPT solid-state NMR spectroscopy and first principles computation. A case study of penicillin G

N. Mifsud; B. Elena; C. J. Pickard; A. Lesage; L. Emsley

Physical Chemistry Chemical Physics. 2006. DOI : 10.1039/b605227d.

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Selective NMR measurements of homonuclear scalar couplings in isotopically enriched solids

S. Cadars; A. Lesage; N. Hedin; B. F. Chmelka; L. Emsley

JOURNAL OF PHYSICAL CHEMISTRY B. 2006. DOI : 10.1021/jp062920v.

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Observation of heteronuclear overhauser effects confirms the N-15-H-1 dipolar relaxation mechanism in a crystalline protein

N. Giraud; J. Sein; G. Pintacuda; A. Bockmann; A. Lesage  et al.

Journal of the American Chemical Society. 2006. DOI : 10.1021/ja064037g.

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Solid-state NMR of a paramagnetic DIAD-Fe-II catalyst: Sensitivity, resolution enhancement, and structure-based assignments

G. Kervern; G. Pintacuda; Y. Zhang; E. Oldfield; C. Roukoss  et al.

Journal of the American Chemical Society. 2006. DOI : 10.1021/ja063510n.

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Better characterization of surface organometallic catalysts through resolution enhancement in proton solid state NMR spectra

F. Blanc; C. Coperet; J. Thivolle-Cazat; J.-M. Basset; A. Lesage  et al.

Inorganic Chemistry. 2006. DOI : 10.1021/ic061222m.

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Multi-dimensional magnetic resonance imaging in a stray magnetic field

J. Baltisberger; S. Hediger; L. Emsley

Journal of Magnetic Resonance. 2005. DOI : 10.1016/j.jmr.2004.09.019.

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Complete assignment of heteronuclear protein resonances by protonless NMR spectroscopy

W. Bermel; I. Bertini; L. Duma; I. Felli; L. Emsley  et al.

Angewandte Chemie-International Edition. 2005. DOI : 10.1002/anie.200461794.

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Chemical shift correlations in disordered solids

S. Cadars; A. Lesage; L. Emsley

Journal of the American Chemical Society. 2005. DOI : 10.1021/ja043698f.

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Through-space contributions to two-dimensional double-quantum J correlation NMR spectra of magic-angle-spinning solids

F. Fayon; D. Massiot; M. Levitt; J. Titman; D. Gregory  et al.

Journal of Chemical Physics. 2005. DOI : 10.1063/1.1898219.

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Powder crystallography by proton solid-state NMR spectroscopy

B. Elena; L. Emsley

Journal of the American Chemical Society. 2005. DOI : 10.1021/ja051208t.

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Water-protein hydrogen exchange in the micro-crystalline protein Crh as observed by solid state NMR spectroscopy

A. Bockmann; M. Juy; E. Bettler; L. Emsley; A. Galinier  et al.

JOURNAL OF BIOMOLECULAR NMR. 2005. DOI : 10.1007/s10858-005-8073-y.

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Well-defined surface tungstenocarbyne complexes through the reaction of [W(=CtBu)(CH(2)tBu)(3)] with silica

E. Le Roux; M. Taoufik; M. Chabanas; D. Alcor; A. Baudouin  et al.

Organometallics. 2005. DOI : 10.1021/om050086a.

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Proton to carbon-13 INEPT in solid-state NMR spectroscopy

B. Elena; A. Lesage; S. Steuernagel; A. Bockmann; L. Emsley

Journal of the American Chemical Society. 2005. DOI : 10.1021/ja054411x.

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Quantitative analysis of backbone dynamics in a crystalline protein from nitrogen-15 spin-lattice relaxation

N. Giraud; M. Blackledge; M. Goldman; A. Bockmann; A. Lesage  et al.

Journal of the American Chemical Society. 2005. DOI : 10.1021/ja055182h.

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Surface organometallic chemistry on metal oxide: The case of silica

C. Coperet; D. Basset; A. Lesage; L. Emsley

2004. p. U1528.

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Transverse dephasing optimised NMR spectroscopy in solids: Natural-abundance C-13 correlation spectra

G. De Paepe; A. Lesage; S. Steuernagel; L. Emsley

CHEMPHYSCHEM. 2004. DOI : 10.1002/cphc.200301062.

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Principles of spin-echo modulation by J-couplings in magic-angle-spinning solid-state NMR

L. Duma; W. Lai; M. Carravetta; L. Emsley; S. Brown  et al.

CHEMPHYSCHEM. 2004. DOI : 10.1002/cphc.200301213.

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Characterization of heteronuclear decoupling through proton spin dynamics in solid-state nuclear magnetic resonance spectroscopy

G. De Paepe; B. Elena; L. Emsley

Journal of Chemical Physics. 2004. DOI : 10.1063/1.1773155.

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Site-specific backbone dynamics from a crystalline protein by solid-state NMR spectroscopy

N. Giraud; A. Bockmann; A. Lesage; F. Penin; M. Blackledge  et al.

Journal of the American Chemical Society. 2004. DOI : 10.1021/ja046578g.

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Molecular understanding of the formation of surface zirconium Hydrides upon thermal treatment under hydrogen of [( SiO)Zr(CH(2)tBU)(3)] by using advanced solid-state NMR techniques

F. Rataboul; A. Baudouin; C. Thieuleux; L. Veyre; C. Coperet  et al.

Journal of the American Chemical Society. 2004. DOI : 10.1021/ja038486h.

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Detailed structural investigation of the grafting of [Ta(=CHtBu)(CH(2)tBu)(3)] and [Cp*TaMe4] on silica partially dehydroxylated at 700 degrees C and the activity of the grafted complexes toward alkane metathesis

E. Le Roux; M. Chabanas; A. Baudouin; A. de Mallmann; C. Coperet  et al.

Journal of the American Chemical Society. 2004. DOI : 10.1021/ja046486r.

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Probing proton-proton proximities in the solid state: High-resolution two-dimensional H-1-H-1 double-quantum CRAMPS NMR spectroscopy

S. Brown; A. Lesage; B. Elena; L. Emsley

Journal of the American Chemical Society. 2004. DOI : 10.1021/ja045461p.

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The 2D MAS NMR spin-echo experiment: the determination of C-13-C-13 J couplings in a solid-state cellulose sample

S. Brown; L. Emsley

Journal of Magnetic Resonance. 2004. DOI : 10.1016/j.jmr.2004.07.022.

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Direct spectral optimisation of proton-proton homonuclear dipolar decoupling in solid-state NMR

B. Elena; G. de Paepe; L. Emsley

Chemical Physics Letters. 2004. DOI : 10.1016/j.cplett.2004.09.122.

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Correlation of fast and slow chemical shift spinning sideband patterns under fast magic-angle spinning

B. Elena; S. Hediger; L. Emsley

Journal of Magnetic Resonance. 2003. DOI : 10.1016/S1090-7807(02)00037-X.

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Perhydrocarbyl Re-VII complexes: Comparison of molecular and surface complexes

M. Chabanas; A. Baudouin; C. Coperet; J. Basset; W. Lukens  et al.

Journal of the American Chemical Society. 2003. DOI : 10.1021/ja020136s.

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Heteronuclear decoupling in NMR of Liquid Crystals using continuous phase modulation

G. De Paepe; D. Sakellariou; P. Hodgkinson; S. Hediger; L. Emsley

Chemical Physics Letters. 2003. DOI : 10.1016/S0009-2614(02)01808-0.

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High-resolution NMR correlation spectra of disordered solids

D. Sakellariou; S. Brown; A. Lesage; S. Hediger; M. Bardet  et al.

Journal of the American Chemical Society. 2003. DOI : 10.1021/ja0292389.

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Carbon-13 lineshapes in solid-state NMR of labeled compounds. Effects of coherent CSA-dipolar cross-correlation

L. Duma; S. Hediger; A. Lesage; D. Sakellariou; L. Emsley

Journal of Magnetic Resonance. 2003. DOI : 10.1016/S1090-7807(02)00174-X.

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Experimental aspects of proton NMR spectroscopy in solids using phase-modulated homonuclear dipolar decoupling

A. Lesage; D. Sakellariou; S. Hediger; B. Elena; P. Charmont  et al.

Journal of Magnetic Resonance. 2003. DOI : 10.1016/S1090-7807(03)00104-6.

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Improved heteronuclear decoupling schemes for solid-state magic angle spinning NMR by direct spectral optimization

G. De Paepe; P. Hodgkinson; L. Emsley

Chemical Physics Letters. 2003. DOI : 10.1016/S0009-2614(03)00966-7.

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Spin-state selection in solid-state NMR

L. Duma; S. Hediger; A. Lesage; L. Emsley

Journal of Magnetic Resonance. 2003. DOI : 10.1016/S1090-7807(03)00187-3.

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The performance of phase modulated heteronuclear dipolar decoupling schemes in fast magic-angle-spinning nuclear magnetic resonance experiments

G. De Paepe; A. Lesage; L. Emsley

Journal of Chemical Physics. 2003. DOI : 10.1063/1.1595088.

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Resolution enhancement in multidimensional solid-state NMR spectroscopy of proteins using spin-state selection

L. Duma; S. Hediger; B. Brutscher; A. Bockmann; L. Emsley

Journal of the American Chemical Society. 2003. DOI : 10.1021/ja036893n.

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Transverse dephasing optimized solid-state NMR spectroscopy

G. De Paepe; N. Giraud; A. Lesage; P. Hodgkinson; A. Bockmann  et al.

Journal of the American Chemical Society. 2003. DOI : 10.1021/ja037213j.

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Germanium on Double-SOI Photodetectors for 1550 nm Operation

O. Dosunmu; M. K. Emsley; D. Cannon; B. Ghyselen; L. Kimerling  et al.

2003. IEEE/LEOS Annual Meeting, Tucson, AZ, October 2003. p. 853-854. DOI : 10.1109/LEOS.2003.1253069.

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Sample restriction using radiofrequency field selective pulses in high-resolution solid-state NMR

P. Charmont; D. Sakellariou; L. Emsley

Journal of Magnetic Resonance. 2002. DOI : 10.1006/jmre.2001.2467.

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Determining hydrogen-bond strengths in the solid state by NMR: the quantitative measurement of homonuclear J couplings

S. Brown; M. Perez-Torralba; D. Sanz; R. Claramunt; L. Emsley

Chemical Communications. 2002. DOI : 10.1039/b205324a.

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Observation of a H-agostic bond in a highly active rhenium-alkylidene olefin metathesis heterogeneous catalyst by two-dimensional solid-state NMR spectroscopy

A. Lesage; L. Emsley; M. Chabanas; C. Coperet; J. Basset

Angewandte Chemie-International Edition. 2002. DOI : 10.1002/1521-3773(20021202)41:23<4535::AID-ANIE4535>3.0.CO;2-O.

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Molecular insight into surface organometallic chemistry through the combined use of 2D HETCOR solid-state NMR spectroscopy and silsesquioxane analogues (vol 40, pg 4493, 2001)

M. Chabanas; E. Quadrelli; B. Fenet; C. Coperet; J. ThivolleCazat  et al.

Angewandte Chemie-International Edition. 2002. DOI : 10.1002/1521-3773(20020104)41:1<16::AID-ANIE333316>3.0.CO;2-O.

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The direct detection of a hydrogen bond in the solid state by NMR through the observation of a hydrogen-bond mediated N-15-N-15 J coupling

S. Brown; M. Perez-Torralba; D. Sanz; R. Claramunt; L. Emsley

Journal of the American Chemical Society. 2002. DOI : 10.1021/ja0172262.

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A new NMR method for the study of local mobility in solids and application to hydration of biopolymers in plant cell walls

S. Hediger; A. Lesage; L. Emsley

MACROMOLECULES. 2002. DOI : 10.1021/ma020065h.

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Through-bond phosphorus-phosphorus connectivities in crystalline and disordered phosphates by solid-state NMR

F. Fayon; G. Le Saout; L. Emsley; D. Massiot

Chemical Communications. 2002. DOI : 10.1039/b205037b.

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Molecular Insight Into Surface Organometallic Chemistry Through the Combined Use of 2D HETCOR Solid-State NMR Spectroscopy and Silsesquioxane Analogues We are also indebted to the CNRS, ENS Lyon, and ESCPE Lyon for financial support. M.C. is grateful to the French ministry of education, research, and technology (MENRT) for a pre-doctoral fellowship. E.A.Q. gratefully acknowledges Università di Pisa and S.N.A.M. for financial support. 2D HETCOR=two-dimensional heteronuclear correlation.

M. Chabanas; E. A. Quadrelli; B. Fenet; C. Copéret; J. Thivolle-Cazat  et al.

Angewandte Chemie International Edition. 2001. DOI : 10.1002/1521-3773(20011203)40:23&lt;4493::AID-ANIE4493&gt;3.0.CO;2-X.

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Through-bond heteronuclear single-quantum correlation spectroscopy in solid-state NMR, and comparison to other through-bond and through-space experiments

A. Lesage; L. Emsley

Journal of Magnetic Resonance. 2001. DOI : 10.1006/jmre.2000.2249.

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Segmental mobility in poly(isoprene) rubber studied by deuterium-carbon NMR correlation spectroscopy

H. Menge; S. Hediger; L. Emsley; D. Sandstrom

POLYMER BULLETIN. 2001. DOI : 10.1007/s002890170073.

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Synthesis of denterium-labeled cryptophane-A and investigation of Xe@Cryptophane complexation dynamics by 1D-EXSY NMR experiments

T. Brotin; T. Devic; A. Lesage; L. Emsley; A. Collet

Chemistry-A European Journal. 2001. DOI : 10.1002/1521-3765(20010401)7:7<1561::AID-CHEM1561>3.3.CO;2-0.

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1-D and 2-D solid state NMR characterization of well-defined Re- and Mo-based catalysts for olefin metathesis

M. Chabanas; R. Saint-Arroman; A. Baudouin; A. Lesage; L. Emsley  et al.

2001. p. U734.

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Characterization of surface organometallic complexes using high resolution 2D solid-state NMR spectroscopy. Application to the full characterization of a silica supported metal carbyne: =SiO-Mo(=-Bu-t(CH2-Bu-t)(2)

R. Saint-Arroman; M. Chabanas; A. Baudouin; C. Coperet; J. Basset  et al.

Journal of the American Chemical Society. 2001. DOI : 10.1021/ja002259n.

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Enhanced sensitivity in RIACT/MQ-MAS NMR experiments using rotor assisted population transfer

H. Kwak; S. Prasad; Z. Yao; P. Grandinetti; J. Sachleben  et al.

Journal of Magnetic Resonance. 2001. DOI : 10.1006/jmre.2001.2313.

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Proton-proton constraints in powdered solids from H-1-H-1-H-1 and H-1-H-1-C-13 three-dimensional NMR chemical shift correlation spectroscopy

D. Sakellariou; A. Lesage; L. Emsley

Journal of the American Chemical Society. 2001. DOI : 10.1021/ja005846h.

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Improved resolution in proton NMR spectroscopy of powdered solids

A. Lesage; L. Duma; D. Sakellariou; L. Emsley

Journal of the American Chemical Society. 2001. DOI : 10.1021/ja0039740.

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Spectral editing in solid-state NMR using scalar multiple quantum filters

D. Sakellariou; A. Lesage; L. Emsley

Journal of Magnetic Resonance. 2001. DOI : 10.1006/jmre.2001.2338.

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Enhanced sensitivity in RIACT/MQ-MAS NMR experiments using rotor assisted population transfer (vol 150, pg 71, 2001)

H. Kwak; S. Prasad; Z. Yao; P. Grandinetti; J. Sachleben  et al.

Journal of Magnetic Resonance. 2001. DOI : 10.1006/jmre.2001.2435.

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Xe-129 NMR spectroscopy of deuterium-labeled cryptophane-A xenon complexes: Investigation of host-guest complexation dynamics

T. Brotin; A. Lesage; L. Emsley; A. Collet

Journal of the American Chemical Society. 2000. DOI : 10.1021/ja993053t.

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Homonuclear dipolar decoupling in solid-state NMR using continuous phase modulation

D. Sakellariou; A. Lesage; P. Hodgkinson; L. Emsley

Chemical Physics Letters. 2000. DOI : 10.1016/S0009-2614(00)00127-5.

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Numerical simulation of solid-state NMR experiments

P. Hodgkinson; L. Emsley

PROGRESS IN NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY. 2000. DOI : 10.1016/S0079-6565(99)00019-9.

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Sample restriction using magnetic field gradients in high-resolution solid-state NMR

P. Charmont; A. Lesage; S. Steuernagel; F. Engelke; L. Emsley

Journal of Magnetic Resonance. 2000. DOI : 10.1006/jmre.2000.2117.

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Simulation of extended periodic systems of nuclear spins

P. Hodgkinson; D. Sakellariou; L. Emsley

Chemical Physics Letters. 2000. DOI : 10.1016/S0009-2614(00)00801-0.

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Sensitivity enhancement of the central transition NMR signal of quadrupolar nuclei under magic-angle spinning

Z. Yao; H. Kwak; D. Sakellariou; L. Emsley; P. Grandinetti

Chemical Physics Letters. 2000. DOI : 10.1016/S0009-2614(00)00805-8.

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Complete resonance assignment of a natural abundance solid peptide by through-bond heteronuclear correlation solid-state NMR

A. Lesage; P. Charmont; S. Steuernagel; L. Emsley

Journal of the American Chemical Society. 2000. DOI : 10.1021/ja0018320.

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Carbon-13 solid-state NMR studies on synthetic model compounds of [4Fe-4S] clusters in the 2(+) state

M. Crozet; M. Chaussade; M. Bardet; L. Emsley; B. Lamotte  et al.

JOURNAL OF PHYSICAL CHEMISTRY A. 2000. DOI : 10.1021/jp002005o.

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Lectures on pulsed NMR (3rd edition)

L. Emsley; D. Laws; A. Pines

1999. Magnetic resonance and brain function : approaches from physics, Varenna on Lake Como, Villa Monastero, 23 June-3 July 1998. p. 45-210. DOI : 10.3254/978-1-61499-224-0-45.

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The structure, conformation and orientational order of fluorinated liquid crystals determined from carbon-13 NMR spectroscopy

E. Ciampi; M. Furby; L. Brennan; J. Emsley; A. Lesage  et al.

LIQUID CRYSTALS. 1999. DOI : 10.1080/026782999205614.

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The accuracy of distance measurements in solid-state NMR

P. Hodgkinson; L. Emsley

Journal of Magnetic Resonance. 1999. DOI : 10.1006/jmre.1999.1759.

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Experimental observation of periodic quasi-equilibria in solid-state NMR

D. Sakellariou; P. Hodgkinson; S. Hediger; L. Emsley

Chemical Physics Letters. 1999. DOI : 10.1016/S0009-2614(99)00648-X.

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Solid-state NMR characterization of hydration effects on polymer mobility in onion cell-wall material

S. Hediger; L. Emsley; M. Fischer

CARBOHYDRATE RESEARCH. 1999. DOI : 10.1016/S0008-6215(99)00195-0.

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Through-bond carbon-carbon connectivities in disordered solids by NMR

A. Lesage; M. Bardet; L. Emsley

Journal of the American Chemical Society. 1999. DOI : 10.1021/ja992272b.

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Intrinsic asymmetry in multidimensional solid-state NMR correlation spectra

S. Caldarelli; L. Emsley

Journal of Magnetic Resonance. 1998. DOI : 10.1006/jmre.1997.1314.

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Assignment and measurement of deuterium quadrupolar couplings in liquid crystals by deuterium-carbon NMR correlation spectroscopy

C. Auger; A. Lesage; S. Caldarelli; P. Hodgkinson; L. Emsley

JOURNAL OF PHYSICAL CHEMISTRY B. 1998. DOI : 10.1021/jp9805398.

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Carbon-13 spectral editing in solid-state NMR using heteronuclear scalar couplings

A. Lesage; S. Steuernagel; L. Emsley

Journal of the American Chemical Society. 1998. DOI : 10.1021/ja981019t.

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Deuterium to carbon cross-polarization in liquid crystals

P. Hodgkinson; C. Auger; L. Emsley

Journal of Chemical Physics. 1998. DOI : 10.1063/1.476764.

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Quasi equilibria in solid-state NMR

D. Sakellariou; P. Hodgkinson; L. Emsley

Chemical Physics Letters. 1998. DOI : 10.1016/S0009-2614(98)00725-8.

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Unidirectional steady state rates of central metabolism enzymes measured simultaneously in a living plant tissue

A. Roscher; L. Emsley; P. Raymond; C. Roby

JOURNAL OF BIOLOGICAL CHEMISTRY. 1998. DOI : 10.1074/jbc.273.39.25053.

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Solution-state NMR studies of the surface structure and dynamics of semiconductor nanocrystals

J. Sachleben; V. Colvin; L. Emsley; E. Wooten; A. Alivisatos

JOURNAL OF PHYSICAL CHEMISTRY B. 1998. DOI : 10.1021/jp9820121.

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Carbon-proton chemical shift correlation in solid-state NMR by through-bond multiple-quantum spectroscopy

A. Lesage; D. Sakellariou; S. Steuernagel; L. Emsley

Journal of the American Chemical Society. 1998. DOI : 10.1021/ja983048+.

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Two-dimensional spin-exchange solid-state NMR studies of C-13-enriched wood

M. Bardet; L. Emsley; M. Vincendon

SOLID STATE NUCLEAR MAGNETIC RESONANCE. 1997. DOI : 10.1016/S0926-2040(96)01273-8.

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Direct observation of unidirectional steady-state enzyme activities in living plant cells

A. Roscher; L. Emsley; C. Roby

PLANT PHYSIOLOGY. 1997.

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Determination of through-bond carbon-carbon connectivities in solid-state NMR using the INADEQUATE experiment

A. Lesage; C. Auger; S. Caldarelli; L. Emsley

Journal of the American Chemical Society. 1997. DOI : 10.1021/ja971089k.

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The reliability of the determination of tensor parameters by solid-state nuclear magnetic resonance

P. Hodgkinson; L. Emsley

Journal of Chemical Physics. 1997. DOI : 10.1063/1.474844.

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Deuterium-carbon NMR correlation spectroscopy in oriented materials

C. Auger; A. Lesage; S. Caldarelli; P. Hodgkinson; L. Emsley

Journal of the American Chemical Society. 1997. DOI : 10.1021/ja972536z.

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The effect of imperfect saturation in saturation-recovery T-1 measurements

A. Roscher; L. Emsley; C. Roby

Journal of Magnetic Resonance SERIES A. 1996. DOI : 10.1006/jmra.1996.0015.

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The effect of spin decoupling on line shapes in solid-state nuclear magnetic resonance

J. Sachleben; S. Caldarelli; L. Emsley

Journal of Chemical Physics. 1996. DOI : 10.1063/1.471000.

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Narrowband linear selective pulses for NMR

P. Borgnat; A. Lesage; S. Caldarelli; L. Emsley

Journal of Magnetic Resonance SERIES A. 1996. DOI : 10.1006/jmra.1996.0090.

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Improved sensitivity in selective NMR correlation spectroscopy and applications to the determination of scalar couplings in peptides and proteins

P. Borgnat; A. Lesage; S. Caldarelli; L. Emsley

Journal of the American Chemical Society. 1996. DOI : 10.1021/ja961162r.

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Measurement of carbon-proton dipolar couplings in liquid crystals by local dipolar field NMR spectroscopy

S. Caldarelli; M. Hong; L. Emsley; A. Pines

JOURNAL OF PHYSICAL CHEMISTRY. 1996. DOI : 10.1021/jp962023z.

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2-DIMENSIONAL MAGIC-ANGLE-SPINNING XE-129 EXCHANGE NMR-STUDY OF XENON ENERGETICS AND DYNAMICS IN NA-A ZEOLITE

I. YANG; R. LARSEN; J. SHORE; K. SCHMIDT-ROHR; L. EMSLEY  et al.

1995. p. 351-CHED.

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PURE-PHASE SELECTIVE EXCITATION IN NMR BY ACQUISITION DURING THE PULSE

S. CALDARELLI; A. LESAGE; L. EMSLEY

Journal of Magnetic Resonance SERIES A. 1995. DOI : 10.1006/jmra.1995.1200.

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Two-Dimensional 29Xe Exchange NMR Measurements of Xenon Dynamics in Na-A Zeolite

M. Janicke; B. Chmelka; R. Larsen; J. Shore; K. Schmidt-Rohr  et al.

1994. 10th International Zeolite Conference, Garmisch-Partenkirchen, Germany, 17-22 July 1994. p. 519-526. DOI : 10.1016/S0167-2991(08)64153-1.

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Selective pulses and their applications to assignment and structure determination in nuclear magnetic resonance

L. Emsley

Nuclear Magnetic Resonance, Part C; Elsevier, 1994. p. 207-246.

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Assessment of MR image deformation for stereotactic neurosurgery using a tagging sequence

R. MEULI; F. VERDUN; F. BOCHUD; L. EMSLEY; H. FANKHAUSER

American Journal of Neuroradiology. 1994.

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Impulsions sélectives et leurs applications à l’attribution des résonances et à la détermination structurale en RMN

L. EMSLEY

Journal de Chimie Physique et de Physico-Chimie Biologique. 1994. DOI : 10.1051/jcp/1994910607.

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SOLID-STATE DYNAMIC PROCESSES IN COMPLEX-SYSTEMS ANALYZED BY 2-DIMENSIONAL ISOTROPIC-ANISOTROPIC CORRELATION NUCLEAR-MAGNETIC-RESONANCE

L. FRYDMAN; S. VALLABHANENI; Y. LEE; L. EMSLEY

Journal of Chemical Physics. 1994. DOI : 10.1063/1.468185.

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NMR MEASUREMENT OF RESOLVED HETERONUCLEAR DIPOLE COUPLINGS IN LIQUID-CRYSTALS AND LIPIDS

K. SCHMIDT-ROHR; D. NANZ; L. EMSLEY; A. PINES

JOURNAL OF PHYSICAL CHEMISTRY. 1994. DOI : 10.1021/j100078a002.

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3-DIMENSIONAL VARIABLE-ANGLE NUCLEAR-MAGNETIC-RESONANCE EXCHANGE SPECTROSCOPY WITHOUT ROTOR AXIS HOPPING

Y. LEE; L. EMSLEY; R. LARSEN; K. SCHMIDT-ROHR; M. HONG  et al.

Journal of Chemical Physics. 1994. DOI : 10.1063/1.467696.

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Methods for reconstructing phase sensitive slice profiles in magnetic resonance imaging

P. Devoulon; L. Emsley; P. Weber; R. Meuli; M. Decorps  et al.

Magnetic resonance in medicine. 1994. DOI : 10.1002/mrm.1910310211.

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LECTURES ON PULSED NMR (2ND EDITION)

L. EMSLEY; A. PINES

1993. NUCLEAR MAGNETIC DOUBLE RESONANCE, SARA BURGERHARTSTRAAT 25, PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS. p. 123-266.

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VARIABLE-ANGLE 3-DIMENSIONAL EXCHANGE NUCLEAR-MAGNETIC-RESONANCE SPECTROSCOPY FOR THE STUDY OF MOLECULAR-MOTION IN COMPLEX SOLIDS

L. FRYDMAN; Y. LEE; L. EMSLEY; G. CHINGAS; A. PINES

Journal of the American Chemical Society. 1993. DOI : 10.1021/ja00064a050.

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DETERMINATION OF DNA CONFORMATIONAL FEATURES FROM SELECTIVE 2-DIMENSIONAL NMR EXPERIMENTS

L. EMSLEY; T. DWYER; H. SPIELMANN; D. WEMMER

Journal of the American Chemical Society. 1993. DOI : 10.1021/ja00070a023.

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NMR-STUDY OF XENON DYNAMICS AND ENERGETICS IN NA-A ZEOLITE

R. LARSEN; J. SHORE; K. SCHMIDT-ROHR; L. EMSLEY; H. LONG  et al.

Chemical Physics Letters. 1993. DOI : 10.1016/0009-2614(93)90085-F.

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NMR-STUDIES OF THE SURFACE-STRUCTURE AND DYNAMICS OF SEMICONDUCTOR NANOCRYSTALS

J. SACHLEBEN; E. WOOTEN; L. EMSLEY; A. PINES; V. COLVIN  et al.

Chemical Physics Letters. 1992. DOI : 10.1016/0009-2614(92)80023-5.

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Optimization of shaped selective pulses for NMR using a quaternion description of their overall propagators

L. Emsley; G. Bodenhausen

Journal of Magnetic Resonance. 1992. DOI : 10.1016/0022-2364(92)90242-Y.

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CORRECTION

L. EMSLEY

Journal of Magnetic Resonance. 1991. DOI : 10.1016/0022-2364(91)90130-L.

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Selective two-dimensional NMR experiments for topological filtration of fragments of coupling networks

L. Emsley; G. Bodenhausen

Journal of the American Chemical Society. 1991. DOI : 10.1021/ja00009a014.

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The role of selective two-dimensional NMR correlation methods in supplementing computer-supported multiplet analysis by MARCO POLO

L. Emsley; G. Bodenhausen

Computational aspects of the study of biological macromolecules by nuclear magnetic resonance spectroscopy; New York: Plenum, 1991. p. 151-62.

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On the use of a slice-selective 270 degrees self-refocusing Gaussian pulse for magnetic resonance imaging: comments on the note by D. M. Doddrell et al

L. Emsley; G. Bodenhausen

Magnetic resonance in medicine. 1991. DOI : 10.1002/mrm.1910190238.

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NMR studies of an oligoproline-containing peptide analogue that binds specifically to the H-2Kd histocompatibility molecule

B. Boulat; L. Emsley; N. Muller; G. Corradin; J. L. Maryanski  et al.

Biochemistry. 1991. DOI : 10.1021/bi00103a006.

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Gauss impulse cascade [Machine Translation]

G. Bodenhausen; L. Emsley

JPH0726924 ; DE59005293 ; EP0502850 ; US5285159 ; JPH05501300 ; DE3940633 ; EP0502850 ; WO9109322 ; DE3940633 . 1991.

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Volume-selective NMR spectroscopy with self-refocusing pulses

L. Emsley; G. Bodenhausen

Journal of Magnetic Resonance. 1990. DOI : 10.1016/0022-2364(90)90081-J.

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Procedures for the selective energize from nmr signals [Machine Translation]

G. Bodenhausen; L. Emsley

JP2621035 ; DE58908113 ; EP0396710 ; US5196795 ; DE3839820 ; JPH03502173 ; EP0396710 ; WO9006523 ; DE3839820 . 1990.

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Phase shifts induced by transient Bloch-Siegert effects in NMR

L. Emsley; G. Bodenhausen

Chemical Physics Letters. 1990. DOI : 10.1016/0009-2614(90)85614-I.

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Measurement of transverse relaxation in coupled spin systems by semi-selective refocusing: evidence for interference of CSA and dipolar relaxation

L. Emsley; J. Kowalewski; G. Bodenhausen

Applied Magnetic Resonance. 1990. DOI : 10.1007/BF03166151.

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Gaussian pulse cascades: new analytical functions for rectangular selective inversion and in-phase excitation in NMR

L. Emsley; G. Bodenhausen

Chemical Physics Letters. 1990. DOI : 10.1016/0009-2614(90)87025-M.

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Double selective inversion in NMR and multiple quantum effects in coupled spin systems

L. Emsley; I. Burghardt; G. Bodenhausen

Journal of Magnetic Resonance. 1990. DOI : 10.1016/0022-2364(90)90381-I.

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Entflechtung überlagernder Multipletts in zweidimensionalen NMR‐Korrelationsspektren durch selektive Inversion der Spins der Kopplungspartner

L. Emsley; P. Huber; G. Bodenhausen

Angewandte Chemie. 1990. DOI : 10.1002/ange.19901020528.

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Self-refocusing effect of 270 Deg Gaussian pulses: applications to selective two-dimensional exchange spectroscopy

L. Emsley; G. Bodenhausen

Journal of Magnetic Resonance. 1989. DOI : 10.1016/0022-2364(89)90185-6.

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Self-refocusing 270 degrees Gaussian pulses for slice selection without gradient reversal in magnetic resonance imaging

L. Emsley; G. Bodenhausen

Magnetic resonance in medicine. 1989. DOI : 10.1002/mrm.1910100212.

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Longitudinal relaxation pathways in scalar-coupled systems

H. Oschkinat; D. Limat; L. Emsley; G. Bodenhausen

Journal of Magnetic Resonance. 1989. DOI : 10.1016/0022-2364(89)90264-3.

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PhD Students

https://people.epfl.ch/327054?lang=en, https://people.epfl.ch/331925?lang=en, https://people.epfl.ch/350569?lang=en, https://people.epfl.ch/354378?lang=en, https://people.epfl.ch/377790?lang=en

Past EPFL PhD Students

Dominik Józef Kubicki, Arthur César Pinon, Albert Hofstetter, Federico Maria Paruzzo, Baptiste Busi, Snaedis Björgvinsdóttir, Martins Balodis, Aditya Mishra, Manuel Cordova, Bruno Simões de Almeida, Yu Rao

Daniele Mammoli, Anna Morales Melgares

Courses

Advanced nuclear magnetic resonance

CH-401

Principles of Magnetic Resonance Imaging (MRI) and applications to medical imaging. Principles of modern multi-dimensional NMR in liquids and solids. Structure determination of proteins & materials. Measurement of molecular dynamics. Principles of Hyperpolarization

Basic and advanced NMR - Level 1 A (EPFL)

CH-601(x)

Basic theoretical and experimental aspects of NMR will be taught. Students will be familarized with modern NMR spectrometers.

Basic and advanced NMR - Level 2 (EPFL)

CH-703

The goal is to give a sound theoretical and practical foundation in NMR for various applications in research. PhD students and post-docs who have followed the course successfully should be able to perform modern multi-dimensional NMR experiments independently.

Experimental physical chemistry

CH-349

Experiments related to physical chemistry courses.

Structural analysis

CH-314

The aim of this course is to treat three of the major techniques for structural characterization of molecules used in chemistry and chemical engineering: mass spectrometry, NMR, and X-ray techniques.