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Protein Engineering|September 1, 1993
Matching chemistry and shape in molecular dockingB K Shoichet, I D KuntzChemistry & Biology|March 1, 1996
Predicting the structure of protein complexes: a step in the right directionB K Shoichet, I D KuntzJournal of Molecular Biology|September 5, 1991
Protein docking and complementarityB K Shoichet, I D KuntzScience (New York, N.Y.)|March 5, 1993
Structure-based discovery of inhibitors of thymidylate synthaseB K Shoichet, R M Stroud, D V Santi, et al.Science (New York, N.Y.)|August 21, 1992
Structure-based strategies for drug design and discoveryI D KuntzBiochemistry|February 4, 1999
Structure-based design of inhibitors specific for bacterial thymidylate synthaseT J Stout, D Tondi, M Rinaldi, et al.Protein Science : a Publication of the Protein Society|May 6, 1998
Flexible ligand docking using conformational ensemblesD M Lorber, B K ShoichetJournal of Medicinal Chemistry|August 16, 1996
Molecular similarity based on DOCK-generated fingerprintsH Briem, I D KuntzPageof 13