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Interaction of Amyloid-β-(1–42) Peptide and Its Aggregates with Lipid/Water Interfaces Probed by Vibrational Sum-Frequency Generation Spectroscopy

The journal of physical chemistry. B, 2021-10, Vol.125 (40), p.11208-11218

2021

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L’impact du p , p ′DichloroDiphenylTrichloroethane ( p , p ′DDT) sur l’activité du récepteur de la FSH

Annales d'endocrinologie, 2014-10, Vol.75 (5), p.328-328

2014

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Electron Density Distributions of Redox Active Mixed Valence Carboxylate Bridged Trinuclear Iron Complexes

Journal of the American Chemical Society, 2003-09, Vol.125 (36), p.11088-11099

2003

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On the Electronic Nature of Low-Barrier Hydrogen Bonds in Enzymatic Reactions

Proceedings of the National Academy of Sciences - PNAS, 1998-10, Vol.95 (22), p.12799-12802

1998

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The Charge Density Distribution in a Model Compound of the Catalytic Triad in Serine Proteases

Chemistry : a European journal, 2001-09, Vol.7 (17), p.3756-3767

2001

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Le récepteur FSHR humain est une cible de polluants émergeants : les dérivés halogénés du bisphénol A

Annales d'endocrinologie, 2022-10, Vol.83 (5), p.319

2022

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The influence of solvation on short strong hydrogen bonds: a density functional theory study of the Asp-His interaction in subtilisins

Chemical communications (Cambridge, England), 2004-03 (5), p.498-499

Schiott, Birgit

2004

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Le perturbateur endocrinien p,p’DDT se comporte comme un modulateur allostérique du récepteur humain de la FSH

Annales d'endocrinologie, 2015-09, Vol.76 (4), p.328-328

2015

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Mechanistic Investigation of the 2,5-Diphenylpyrrolidine-Catalyzed Enantioselective α-Chlorination of Aldehydes

Chemistry : a European journal, 2005-11, Vol.11 (23), p.7083-7090

2005

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Reaction Mechanism of Soluble Epoxide Hydrolase: Insights from Molecular Dynamics Simulations

Journal of the American Chemical Society, 2002-12, Vol.124 (49), p.14558-14570

2002

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Possible involvement of collective domain movement in the catalytic reaction of soluble epoxide hydrolase

International journal of quantum chemistry, 2004, Vol.99 (2), p.61-69

Schiøtt, Birgit

2004

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Le perturbateur endocrinien p , p ’DDT se comporte comme un modulateur allostérique du récepteur humain de la FSH

Annales d'endocrinologie, 2015, Vol.76 (4), p.328-328

2015

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Enantioselective Hydrosilylation of Ketones with a Chiral Titanocene Catalyst

Journal of the American Chemical Society, 1994-12, Vol.116 (26), p.11667-11670

1994

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Characterization of the Short Strong Hydrogen Bond in Benzoylacetone by ab Initio Calculations and Accurate Diffraction Experiments. Implications for the Electronic Nature of Low-Barrier Hydrogen Bonds in Enzymatic Reactions

Journal of the American Chemical Society, 1998-11, Vol.120 (46), p.12117-12124

1998

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Cofactor Activation and Substrate Binding in Pyruvate Decarboxylase. Insights into the Reaction Mechanism from Molecular Dynamics Simulations

Biochemistry (Easton), 2005-11, Vol.44 (45), p.14792-14806

2005

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Testing theory beyond molecular structure: Electron density distributions of complex molecules

International journal of quantum chemistry, 2004, Vol.96 (1), p.23-31

2004

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Metallaoxetanes as intermediate in oxygen-transfer reactions - reality or fiction?

Chemical reviews, 1990-12, Vol.90 (8), p.1483-1506

1990

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Molecular Dynamics Simulations of Ground and Transition States for the Hydride Transfer from Formate to NAD+ in the Active Site of Formate Dehydrogenase

Journal of the American Chemical Society, 1999-09, Vol.121 (36), p.8164-8173

1999

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Formation of maleic anhydride on a vanadyl pyrophosphate surface: a theoretical study of the mechanism

Journal of physical chemistry (1952), 1991-03, Vol.95 (6), p.2297-2307

1991

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Theoretical Investigation of the Hydride Transfer from Formate to NAD+ and the Implications for the Catalytic Mechanism of Formate Dehydrogenase

Journal of the American Chemical Society, 1998-07, Vol.120 (29), p.7192-7200

1998

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The oxidative species on a vanadyl pyrophosphate surface: A model for some steps in the maleic anhydride synthesis

Catalysis today, 1993-01, Vol.16 (1), p.79-90

1993

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Coadsorption of carbon monoxide and hydrogen on the Ni(100) surface : a theoretical investigation of site preferences and surface bonding

Journal of physical chemistry (1952), 1990-02, Vol.94 (4), p.1554-1564

1990

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Addition of aldehydes to tantalum-carbene complexes and the reduction of epoxides by unsaturated tantalum complexes. Theoretical study of the reaction mechanism and product structures

Organometallics, 1992-12, Vol.11 (12), p.4213-4221

1992

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Stepwise of concerted addition of 1,3-butadiene to oxygen adsorbed on the Ag(110) surface ?

Journal of physical chemistry (1952), 1993-10, Vol.97 (41), p.10738-10741

1993

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Ethylidyne on the Rh(100) surface : a theoretical investigation

Langmuir, 1990-04, Vol.6 (4), p.806-816

1990

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Interaction of Amyloid-β-(1–42) Peptide and Its Aggregates with Lipid/Water Interfaces Probed by Vibrational Sum-Frequency Generation Spectroscopy

L’impact du p , p ′DichloroDiphenylTrichloroethane ( p , p ′DDT) sur l’activité du récepteur de la FSH

Electron Density Distributions of Redox Active Mixed Valence Carboxylate Bridged Trinuclear Iron Complexes

On the Electronic Nature of Low-Barrier Hydrogen Bonds in Enzymatic Reactions

The Charge Density Distribution in a Model Compound of the Catalytic Triad in Serine Proteases

Le récepteur FSHR humain est une cible de polluants émergeants : les dérivés halogénés du bisphénol A

The influence of solvation on short strong hydrogen bonds: a density functional theory study of the Asp-His interaction in subtilisins

Le perturbateur endocrinien p,p’DDT se comporte comme un modulateur allostérique du récepteur humain de la FSH

Mechanistic Investigation of the 2,5-Diphenylpyrrolidine-Catalyzed Enantioselective α-Chlorination of Aldehydes

Reaction Mechanism of Soluble Epoxide Hydrolase: Insights from Molecular Dynamics Simulations

Possible involvement of collective domain movement in the catalytic reaction of soluble epoxide hydrolase

Le perturbateur endocrinien p , p ’DDT se comporte comme un modulateur allostérique du récepteur humain de la FSH

Enantioselective Hydrosilylation of Ketones with a Chiral Titanocene Catalyst

Characterization of the Short Strong Hydrogen Bond in Benzoylacetone by ab Initio Calculations and Accurate Diffraction Experiments. Implications for the Electronic Nature of Low-Barrier Hydrogen Bonds in Enzymatic Reactions

Cofactor Activation and Substrate Binding in Pyruvate Decarboxylase. Insights into the Reaction Mechanism from Molecular Dynamics Simulations

Testing theory beyond molecular structure: Electron density distributions of complex molecules

Metallaoxetanes as intermediate in oxygen-transfer reactions - reality or fiction?

Molecular Dynamics Simulations of Ground and Transition States for the Hydride Transfer from Formate to NAD+ in the Active Site of Formate Dehydrogenase

Formation of maleic anhydride on a vanadyl pyrophosphate surface: a theoretical study of the mechanism

Theoretical Investigation of the Hydride Transfer from Formate to NAD+ and the Implications for the Catalytic Mechanism of Formate Dehydrogenase

The oxidative species on a vanadyl pyrophosphate surface: A model for some steps in the maleic anhydride synthesis

Coadsorption of carbon monoxide and hydrogen on the Ni(100) surface : a theoretical investigation of site preferences and surface bonding

Addition of aldehydes to tantalum-carbene complexes and the reduction of epoxides by unsaturated tantalum complexes. Theoretical study of the reaction mechanism and product structures

Stepwise of concerted addition of 1,3-butadiene to oxygen adsorbed on the Ag(110) surface ?

Ethylidyne on the Rh(100) surface : a theoretical investigation

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