Prediction of protein-ligand interactions. Docking and scoring: successes and gaps.
Leach
Andrew R
AR
GlaxoSmithKline Pharmaceuticals, 1250 South Collegeville Road, Collegeville, Pennsylvania 19426, USA.
Shoichet
Brian K
BK
Peishoff
Catherine E
CE
D001665:Binding Sites; D015195:Drug Design; D008024:Ligands; D008958:Models, Molecular; D011485:Protein Binding; D011506:Proteins / Q000737:chemistry*; D021281:Quantitative Structure-Activity Relationship
D008024:Ligands; D011506:Proteins