Scott D. Bembenek

Ligand Binding Efficiency: Trends, Physical Basis, and Implications

Charles H. Reynolds, Brett A. Tounge, Scott D. Bembenek · Journal of Medicinal Chemistry · 2008 · 308 citations

Efficient Ligands, Medicinal Chemistry, Drug Target +14

The role of molecular size in ligand efficiency

Charles H. Reynolds, Scott D. Bembenek, Brett A. Tounge · Bioorganic & Medicinal Chemistry Letters · 2007 · 164 citations

Engineering, Biochemistry, Ligand Efficiency +4

D3R Grand Challenge 3: blind prediction of protein–ligand poses and affinity rankings

Zied Gaieb, conor parks, Michael Chiu et al. · Journal of Computer-Aided Molecular Design · 2019 · 147 citations

Blind Prediction, Engineering, Protein–ligand Poses +11

D3R grand challenge 4: blind prediction of protein–ligand poses, affinity rankings, and relative binding free energies

conor parks, Zied Gaieb, Michael Chiu et al. · Journal of Computer-Aided Molecular Design · 2020 · 138 citations · Full text

Blind Prediction, Engineering, Protein–ligand Poses +12

Instantaneous Normal Modes and the Glass Transition

Scott D. Bembenek, Brian B. Laird · Physical Review Letters · 1995 · 130 citations · Full text

Engineering, Soft Mode, Physics +13