Collaboration, competition, validation and plans for the future Wendy A. Warr Warr’s Piece 05 October 2010 Pages: 887 - 890
Trainable structure–activity relationship model for virtual screening of CYP3A4 inhibition Remigijus DidziapetrisJustas DapkunasPranas Japertas OriginalPaper 01 September 2010 Pages: 891 - 906
Calibrative approaches to protein solubility modeling of a mutant series using physicochemical descriptors William F. LongP. Labute OriginalPaper Open access 15 September 2010 Pages: 907 - 916
Defining scaffold geometries for interacting with proteins: geometrical classification of secondary structure linking regions Tran T. TranChristina KulisMark L. Smythe OriginalPaper 23 September 2010 Pages: 917 - 934
pKa based protonation states and microspecies for protein–ligand docking Tim ten BrinkThomas E. Exner OriginalPaper 30 September 2010 Pages: 935 - 942
Insights into the binding mode and mechanism of action of some atypical retinoids as ligands of the small heterodimer partner (SHP) Marco CellanettiViswanath GundaRoberto Pellicciari OriginalPaper 30 September 2010 Pages: 943 - 956