Shashidhar N. Rao

PHASE: a new engine for pharmacophore perception, 3D QSAR model development, and 3D database screening: 1. Methodology and preliminary results

Steven L. Dixon, Alexander M. Smondyrev, Eric H. Knoll et al. · Journal of Computer-Aided Molecular Design · 2006 · 1.2K citations

Pharmacy, Medicinal Chemistry, Pharmacology +17

PHASE: A Novel Approach to Pharmacophore Modeling and 3D Database Searching

Steven L. Dixon, Alexander M. Smondyrev, Shashidhar N. Rao · Chemical Biology & Drug Design · 2006 · 689 citations · Full text

Pharmacy, Medicinal Chemistry, Pharmacology +17

Validation Studies of the Site-Directed Docking Program LibDock

Shashidhar N. Rao, Martha S. Head, Amit Kulkarni et al. · Journal of Chemical Information and Modeling · 2007 · 394 citations · Full text

Pharmacy, Medicinal Chemistry, Pharmacology +17

Free energy perturbation calculations on binding and catalysis after mutating Asn 155 in subtilisin

Shashidhar N. Rao, U. Chandra Singh, Paul A. Bash et al. · Nature · 1987 · 226 citations

Life Sciences, Biochemistry, Molecular Biology +14

Potent in vitro and in vivo inhibitors of platelet aggregation based upon the Arg-Gly-Asp-Phe sequence of fibrinogen. A proposal on the nature of the binding interaction between the Arg-guanidine of RGDX mimetics and the platelet GP IIb-IIIa receptor

Jeffery A. Zablocki, Masateru Miyano, Robert B. Garland et al. · Journal of Medicinal Chemistry · 1993 · 107 citations

Medicine, Medicinal Chemistry, Pharmacology +17