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Journal of Computer-Aided Molecular Design|June 25, 2008
QSAR of heterocyclic antifungal agents by flip regressionOmar Deeb, Brian W ClareJournal of Computer-Aided Molecular Design|October 4, 2006
A marriage made in torsional space: using GALAHAD models to drive pharmacophore multiplet searchesJennifer K Shepphird, Robert D ClarkJournal of Computer-Aided Molecular Design|September 17, 2004
VEGA--an open platform to develop chemo-bio-informatics applications, using plug-in architecture and script programmingAlessandro Pedretti, Luigi Villa, Giulio VistoliJournal of Computer-Aided Molecular Design|May 6, 2004
A structure-activity relationship study of catechol-O-methyltransferase inhibitors combining molecular docking and 3D QSAR methodsAnu J Tervo, Tommi H Nyrönen, Toni Rönkkö, et al.Journal of Computer-Aided Molecular Design|May 6, 2004
Prediction of in vitro metabolic stability of calcitriol analogs by QSARBerith F Jensen, Morten D Sørensen, Anne-Marie Kissmeyer, et al.Journal of Computer-Aided Molecular Design|August 2, 2005
A support vector machine approach to classify human cytochrome P450 3A4 inhibitorsJan M Kriegl, Thomas Arnhold, Bernd Beck, et al.Journal of Computer-Aided Molecular Design|August 2, 2005
Towards the chemometric dissection of peptide--HLA-A*0201 binding affinity: comparison of local and global QSAR modelsIrini A Doytchinova, Valerie Walshe, Persephone Borrow, et al.Journal of Computer-Aided Molecular Design|November 26, 2004
Scoring protein-protein docked structures based on the balance and tightness of bindingY H Yu, B Z Lu, J G Han, et al.Journal of Computer-Aided Molecular Design|November 26, 2004
Docking and scoring of metallo-beta-lactamases inhibitorsLars Olsen, Ingrid Pettersson, Lars Hemmingsen, et al.Journal of Computer-Aided Molecular Design|November 26, 2003
3D QSAR studies on binding affinities of coumarin natural products for glycosomal GAPDH of Trypanosoma cruziIrwin R A Menezes, Julio C D Lopes, Carlos A Montanari, et al.Pageof 263