Publication & Citation Trends
Publications
0 total
Development of the Quantum-Inspired SIBFA Many-Body Polarizable Force Field: Enabling Condensed-Phase Molecular Dynamics Simulations. OA
Cited by 31
Semantic Scholar
NCI: looking at solute/solvent interactions OA
Cited by 1
Semantic Scholar
A Complete NCI Perspective: From New Bonds to Reactivity OA
Cited by 45
Semantic Scholar
Scalable improvement of SPME multipolar electrostatics in anisotropic polarizable molecular mechanics using a general short‐range penetration correction up to quadrupoles OA
Cited by 28
Semantic Scholar
Addressing the Issues of Non-isotropy and Non-additivity in the Development of Quantum Chemistry-Grounded Polarizable Molecular Mechanics OA
Cited by 2
Semantic Scholar
Electron transfer, decoherence, and protein dynamics: insights from atomistic simulations.
Cited by 30
Semantic Scholar
General Model for Treating Short-Range Electrostatic Penetration in a Molecular Mechanics Force Field OA
Cited by 101
Semantic Scholar
S/G-1: an ab initio force-field blending frozen Hermite Gaussian densities and distributed multipoles. Proof of concept and first applications to metal cations.
Cited by 22
Semantic Scholar
Research Topics
Advanced Chemical Physics Studies
(5)
Spectroscopy and Quantum Chemical Studies
(5)
Protein Structure and Dynamics
(4)
DNA and Nucleic Acid Chemistry
(3)
Photosynthetic Processes and Mechanisms
(2)
Affiliations
Université Paris-Sud
Centre National de la Recherche Scientifique
Sorbonne Université
Laboratoire de Chimie Théorique
Laboratoire de Chimie Physique