Raphaël Geney

Improved Efficiency of Replica Exchange Simulations through Use of a Hybrid Explicit/Implicit Solvation Model

Asim Okur, Lauren Wickstrom, Melinda Layten et al. · Journal of Chemical Theory and Computation · 2006 · 148 citations

Chemical Kinetics, Engineering, Computational Chemistry +16

Investigation of Salt Bridge Stability in a Generalized Born Solvent Model

Raphaël Geney, Melinda Layten, Roberto Gomperts et al. · Journal of Chemical Theory and Computation · 2005 · 116 citations

Protein Chemistry, Salt Bridge Formation, Engineering +14

Triazolopyridines as Selective JAK1 Inhibitors: From Hit Identification to GLPG0634

Christel Menet, Stephen R. Fletcher, Guy Van Lommen et al. · Journal of Medicinal Chemistry · 2014 · 116 citations · Full text

Drug Target, Hit Identification, Janus Kinases +26

Use of the Tubulin Bound Paclitaxel Conformation for Structure-Based Rational Drug Design

Raphaël Geney, Liang Sun, Paula Pera et al. · Chemistry & Biology · 2005 · 76 citations · Full text

Medicinal Chemistry, Biochemistry, Drug Design +10

Design and synthesis of de novo cytotoxic alkaloids through mimicking taxoid skeleton

Xudong Geng, Raphaël Geney, Paula Pera et al. · Bioorganic & Medicinal Chemistry Letters · 2004 · 29 citations

Taxoid Skeleton, Biochemistry, Medicine +6