Emilio Xavier Esposito

CSAR Benchmark Exercise of 2010: Combined Evaluation Across All Submitted Scoring Functions

Richard D. Smith, James B. Dunbar, Peter M.U. Ung et al. · Journal of Chemical Information and Modeling · 2011 · 147 citations · Full text

Performance Benchmarking, Engineering, Biomolecular Structure Prediction +28

CSAR Data Set Release 2012: Ligands, Affinities, Complexes, and Docking Decoys

James B. Dunbar, Richard D. Smith, Kelly L. Damm‐Ganamet et al. · Journal of Chemical Information and Modeling · 2013 · 123 citations · Full text

Drug Target, Molecular Biology, Entire Active Site +19

Methods for Applying the Quantitative Structure-Activity Relationship Paradigm

Emilio Xavier Esposito, A. J. Hopfinger, Jeffry D. Madura · Methods in molecular biology · 2004 · 122 citations

In Silico Binary Classification QSAR Models Based on 4D-Fingerprints and MOE Descriptors for Prediction of hERG Blockage

Bo‐Han Su, Mengyu Shen, Emilio Xavier Esposito et al. · Journal of Chemical Information and Modeling · 2010 · 70 citations

Docking of sulfonamides to carbonic anhydrase II and IV

Emilio Xavier Esposito, Kelli Baran, K. Kelly et al. · Journal of Molecular Graphics and Modelling · 2000 · 47 citations

Organic Chemistry, Anhydrase Ii, Chemistry +1