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An improved monomeric infrared fluorescent protein for neuronal and tumour brain imaging.

Dan Yu , William Clay Gustafson , Chun Han , Céline Lafaye , Marjolaine Noirclerc-Savoye , et al.
Nature Communications, 2014, 5, pp.3626
Journal articles hal-01109965v1

Excited state dynamics of the photoconvertible fluorescent protein Kaede revealed by ultrafast spectroscopy

E. Fron , M. Sliwa , Virgile Adam , J. Michiels , Susana Rocha , et al.
Photochemical & Photobiological Sciences , 2014, 13, pp.867 - 874. ⟨10.1039/c3pp50335f⟩
Journal articles hal-01113460v1

300-Fold increase in production of the Zn2+-dependent dechlorinase TrzN in soluble form via apoenzyme stabilization.

Colin J Jackson , Christopher W Coppin , Paul D Carr , Alexey Aleksandrov , Matthew Wilding , et al.
Applied and Environmental Microbiology, 2014, 80 (13), pp.4003-11
Journal articles hal-01131260v1

Design, synthesis and biological evaluation of novel tetrahydroacridine pyridine- aldoxime and -amidoxime hybrids as efficient uncharged reactivators of nerve agent-inhibited human acetylcholinesterase

Maria Kliachyna , Gianluca Santoni , Valentin Nussbaum , Julien Renou , Benoît Sanson , et al.
European Journal of Medicinal Chemistry, 2014, 78, pp.455-467. ⟨10.1016/j.ejmech.2014.03.044⟩
Journal articles hal-01131268v1

Correlation of the dynamics of native human acetylcholinesterase and its inhibited huperzine A counterpart from sub-picoseconds to nanoseconds.

M Trapp , M Tehei , Marie Trovaslet , Florian Nachon , Nicolas Martinez , et al.
Journal of the Royal Society Interface, 2014, 11 (97), pp.20140372
Journal articles hal-01131840v1

Structural and dynamical properties of reconstituted myelin sheaths in the presence of myelin proteins MBP and P2 studied by neutron scattering.

Wiebke Knoll , Judith Peters , Petri Kursula , Yuri Gerelli , Jacques Ollivier , et al.
Soft Matter, 2014, 10 (3), pp.519-29
Journal articles hal-01131824v1

Protein crystal structure obtained at 2.9 Å resolution from injecting bacterial cells into an X-ray free-electron laser beam.

Michael R Sawaya , Duilio Cascio , Mari Gingery , Jose Rodriguez , Lukasz Goldschmidt , et al.
Proceedings of the National Academy of Sciences of the United States of America, 2014, 111 (35), pp.12769-74
Journal articles hal-01131830v1

Simple Link Atom Saccharide Hybrid (SLASH) Treatment for Glycosidic Bonds at the QM/MM Boundary

Crous Werner , Martin J Field , Kevin J Naidoo
Journal of Chemical Theory and Computation, 2014, 10 (4), pp.1727-1738
Journal articles hal-01161764v1

Molecular mobility in Medicago truncatula seed during early stage of germination : Neutron Scattering and NMR investigations.

Xavier Falourd , Francesca Natali , Judith Peters , Loic Foucat
Chemical Physics, 2014, 428, pp.181-185
Journal articles hal-01161769v1

Nanoparticle surface-enhanced Raman scattering of bacteriorhodopsin stabilized by amphipol A8-35.

V Polovinkin , T Balandin , O Volkov , Ekaterina Round , V Borshchevskiy , et al.
Journal of Membrane Biology, 2014, 247 (9-10), pp.971-80
Journal articles hal-01130634v1

Reaction site-driven regioselective synthesis of AChE inhibitors

Emilia Oueis , Gianluca Santoni , Cyril Ronco , Olga A. Syzgantseva , Vincent Tognetti , et al.
Organic & Biomolecular Chemistry, 2014, 12 (1), pp.156-161. ⟨10.1039/C3OB42109K⟩
Journal articles hal-02335933v1

Green-to-red photoconvertible Dronpa mutant for multimodal super-resolution fluorescence microscopy

Benjamien Moeyaert , Ngan Nguyen Bich , Elke de Zitter , Susana Rocha , Koen Clays , et al.
ACS Nano, 2014, 8 (2), pp.1664-1673. ⟨10.1021/nn4060144⟩
Journal articles hal-03513242v1

Low-dose X-ray radiation induces structural alterations in proteins.

Valentin Borshchevskiy , Ekaterina Round , Ivan Erofeev , Martin Weik , Andrii Ishchenko , et al.
Acta crystallographica Section D : Structural biology [1993-..], 2014, 70 (Pt 10), pp.2675-85
Journal articles hal-01130625v1

Phototransformable fluorescent proteins: which one for which application?

Virgile Adam
Histochemistry and Cell Biology, 2014, 142 (1), pp.19-41
Journal articles hal-01131208v1

Theoretical modeling of low-energy electronic absorption bands in reduced cobaloximes.

Anirban Bhattacharjee , Murielle Chavarot-Kerlidou , Jillian L. Dempsey , Harry B. Gray , Etsuko Fujita , et al.
ChemPhysChem, 2014, 15 (14), pp.2951-8. ⟨10.1002/cphc.201402398⟩
Journal articles hal-01069153v1

Hydrolysis of DFP and the nerve agent (S)-sarin by DFPase proceeds along two different reaction pathways: implications for engineering bioscavengers.

Troy Wymore , Martin J Field , Paul Langan , Jeremy C Smith , Jerry M Parks
Journal of Physical Chemistry B, 2014, 118 (17), pp.4479-89
Journal articles hal-01131849v1

The boson peak of deeply cooled confined water reveals the existence of a low-temperature liquid-liquid crossover.

Antonio Cupane , Margarita Fomina , Giorgio Schirò
Journal of Chemical Physics, 2014, 141 (18), pp.18C510
Journal articles hal-01131241v1

Discovery, biological evaluation, and crystal structure of a novel nanomolar selective butyrylcholinesterase inhibitor.

Boris Brus , Urban Košak , Samo Turk , Anja Pišlar , Nicolas Coquelle , et al.
Journal of Medicinal Chemistry, 2014, 57 (19), pp.8167-79
Journal articles hal-01131216v1

Structural and electronic snapshots during the transition from a Cu(II) to Cu(I) metal center of a lytic polysaccharide monooxygenase by X-ray photoreduction.

Mikael Gudmundsson , Seonah Kim , Miao Wu , Takuya Ishida , Majid Hadadd Momeni , et al.
Journal of Biological Chemistry, 2014, 289 (27), pp.18782-92
Journal articles hal-01131256v1

Structures of a human blood group glycosyltransferase in complex with a photo-activatable UDP-Gal derivative reveal two different binding conformations.

René Jørgensen , Gaëlle Batot , Karin Mannerstedt , Anne Imberty , Christelle Breton , et al.
Acta crystallographica Section F : Structural biology communications [2014-..], 2014, 70 (Pt 8), pp.1015-21
Journal articles hal-01131262v1

QM/MM through the 1990s: The First Twenty Years of Method Development and Applications

Meiyi Liu , Ying-Jie Wang , Yakun Chen , Martin J Field , Jiali Gao
Israel Journal of Chemistry, 2014, 54 (8-9), pp.1250-1263. ⟨10.1002/ijch.201400036⟩
Journal articles hal-01161780v1

Deep sea microbes probed by incoherent neutron scattering under high hydrostatic pressure.

Judith Peters , Nicolas Martinez , Grégoire Michoud , Anaïs Cario , Bruno Franzetti , et al.
Zeitschrift für Physikalische Chemie, 2014, 228, 10-12, pp.1121-1133. ⟨10.1515/zpch-2014-0547⟩
Journal articles hal-01149032v1

Characterization of the divalent metal binding site of bacterial polysaccharide deacetylase using crystallography and quantum chemical calculations

Md Munan Shaik , Nicholus Bhattacharjee , Anirban Bhattacharjee , Martin J Field , Giuseppe Zanotti
Proteins - Structure, Function and Bioinformatics, 2014, 82 (7), pp.1311 - 1318. ⟨10.1002/prot.24497⟩
Journal articles istex hal-01662433v1

Structural basis of photoswitching in fluorescent proteins.

Chenxi Duan , Virgile Adam , Martin Byrdin , Dominique Bourgeois
Methods in Molecular Biology, 2014, 1148, pp.177-202
Journal articles hal-01131245v1

Structure-guided simulations illuminate the mechanism of ATP transport through VDAC1.

Om P Choudhary , Aviv Paz , Joshua L Adelman , Jacques-Philippe Colletier , Jeff Abramson , et al.
Nature Structural and Molecular Biology, 2014, 21 (7), pp.626-32
Journal articles hal-01131228v1

The Mechanism of Citryl-Coenzyme A Formation Catalyzed by Citrate Synthase

Alexey Aleksandrov , Elena Zvereva , Martin J Field
Journal of Physical Chemistry B, 2014, 118 (17), pp.4505-4513. ⟨10.1021/jp412346g⟩
Journal articles hal-00998107v1