Samuel Toba
American Chemical Society(US)
Publications by Year
Research Areas
Chemical Synthesis and Analysis, Computational Drug Discovery Methods, Protein Structure and Dynamics, Protease and Inhibitor Mechanisms, Enzyme Structure and Function
Most-Cited Works
- → Small Molecule Affinity Fingerprinting(2002)169 cited
- → Solvent Dynamics and Mechanism of Proton Transfer in Human Carbonic Anhydrase II(1999)126 cited
- → A Molecular Basis for the Selectivity of Thiadiazole Urea Inhibitors with Stromelysin-1 and Gelatinase-A from Generalized Born Molecular Dynamics Simulations(2004)70 cited
- → Design, docking, and evaluation of multiple libraries against multiple targets(2001)58 cited
- → Rationalization of the Enantioselectivity of Subtilisin in DMF(1999)51 cited
- → Using Pharmacophore Models To Gain Insight into Structural Binding and Virtual Screening: An Application Study with CDK2 and Human DHFR(2006)48 cited
- → Binding Preferences of Hydroxamate Inhibitors of the Matrix Metalloproteinase Human Fibroblast Collagenase(1999)42 cited
- → The Concept of Solvent Compatibility and Its Impact on Protein Stability and Activity Enhancement in Nonaqueous Solvents(1997)39 cited
- → SitePrint: Three-Dimensional Pharmacophore Descriptors Derived from Protein Binding Sites for Family Based Active Site Analysis, Classification, and Drug Design(2004)10 cited
- → Automated platform for recording high quality short Scientific Videos(2016)1 cited