José I. Borrell

发表

Comparison of Ligand-Based and Receptor-Based Virtual Screening of HIV Entry Inhibitors for the CXCR4 and CCR5 Receptors Using 3D Ligand Shape Matching and Ligand-Receptor Docking

David W. Ritchie, Rosalia Pascual, Obdulia Rabal, 2008, J. Chem. Inf. Model..

Design and Analysis of a Combinatorial Library of HEPT Analogues: Comparison of Selection Methodologies and Inspection of the Actually Covered Chemical Space

Johann Gasteiger, Rosalia Pascual, José I. Borrell, 2003, J. Chem. Inf. Comput. Sci..

Discovery of Novel HIV Entry Inhibitors for the CXCR4 Receptor by Prospective Virtual Screening

David W. Ritchie, Violeta I. Pérez-Nueno, José I. Borrell, 2009, J. Chem. Inf. Model..

Clustering and Classifying Diverse HIV Entry Inhibitors Using a Novel Consensus Shape-Based Virtual Screening Approach: Further Evidence for Multiple Binding Sites within the CCR5 Extracellular Pocket

David W. Ritchie, Violeta I. Pérez-Nueno, José I. Borrell, 2008, J. Chem. Inf. Model..

Analysis of selection methodologies for combinatorial library design

Rosalia Pascual, José I. Borrell, Jordi Teixidó, 2004, Molecular Diversity.

Cell-Integral-Diversity Criterion: A Proposal for Minimizing Cluster Artifact in Cell-Based Selections

Rosalia Pascual, Obdulia Rabal, José I. Borrell, 2007, J. Chem. Inf. Model..

APIF: A New Interaction Fingerprint Based on Atom Pairs and Its Application to Virtual Screening

Obdulia Rabal, Violeta I. Pérez-Nueno, José I. Borrell, 2009, J. Chem. Inf. Model..

Improving VEGFR-2 Docking-Based Screening by Pharmacophore Postfiltering and Similarity Search Postprocessing

Violeta I. Pérez-Nueno, José I. Borrell, Jordi Teixidó, 2011, J. Chem. Inf. Model..

Use of combinatorial chemistry to develop photocurable thermoplastic polyurethane elastomers (TPUs)

José I. Borrell, Salvador Borrós, Jaume Heras, 2004, Molecular Diversity.

A Priori Prediction of Substituent and Solvent Effects in the Basicity of Nitriles

Modesto Orozco, José I. Borrell, Jordi Teixidó, 1998 .