Nicolas Baurin

Design and Characterization of Libraries of Molecular Fragments for Use in NMR Screening against Protein Targets

Nicolas Baurin, Fareed Aboul‐ela, Xavier Barril et al. · Journal of Chemical Information and Computer Sciences · 2004 · 130 citations

Drug Target, Structural Bioinformatics, Biomolecular Structure Prediction +19

Drug-like Annotation and Duplicate Analysis of a 23-Supplier Chemical Database Totalling 2.7 Million Compounds

Nicolas Baurin, Ruth L. Baker, C. E. Richardson et al. · Journal of Chemical Information and Computer Sciences · 2004 · 114 citations

Drug-like Annotation, Pharmaceutical Chemistry, Medicinal Chemistry +17

Three-Dimensional Quantitative Structure−Activity Relationships of Cyclo-oxygenase-2 (COX-2) Inhibitors: A Comparative Molecular Field Analysis

Philippe Chavatte, Christophe Marot, Nicolas Baurin et al. · Journal of Medicinal Chemistry · 2001 · 111 citations · Full text

Cox-2 Enzyme Topology, Medicinal Chemistry, Drug Target +14

Large-Scale Comparison of Four Binding Site Detection Algorithms

Peter Schmidtke, Catherine Souaille, Frédéric Estienne et al. · Journal of Chemical Information and Modeling · 2010 · 89 citations

2D QSAR Consensus Prediction for High-Throughput Virtual Screening. An Application to COX-2 Inhibition Modeling and Screening of the NCI Database

Nicolas Baurin, Jean‐Christophe Mozziconacci, Éric Arnoult et al. · Journal of Chemical Information and Computer Sciences · 2003 · 73 citations

Drug Target, Engineering, Hit Identification +20