Sensitivity of molecular docking to induced fit effects in influenza virus neuraminidase Louise BirchChristopher W. MurrayMarcel L. Verdonk OriginalPaper Pages: 855 - 869
AstexViewerTM †: a visualisation aid for structure-based drug design Michael J. Hartshorn Legacy Pages: 871 - 881
Distilling the essential features of a protein surface for improving protein-ligand docking, scoring, and virtual screening Maria I. ZavodszkyPaul C. SanschagrinRajesh S. Korde OriginalPaper Pages: 883 - 902
Flexsim-R: A virtual affinity fingerprint descriptor to calculate similarities of functional groups Alexander WeberAndreas TeckentrupHans Briem OriginalPaper Pages: 903 - 916
On the molecular interaction between lactoferrin and the dye Red HE-3B. A novel approach for docking a charged and highly flexible molecule to protein surfaces Mariano GrasselliOsvaldo CasconeJose M. Delfino OriginalPaper Pages: 917 - 934
A structure-based design approach for the identification of novel inhibitors: application to an alanine racemase Gabriela Iurcu MustataJames M. Briggs OriginalPaper Pages: 935 - 953