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Acta Poloniae Pharmaceutica|April 11, 2001
Some computational aspects of theoretical anti-HIV drug designP CieplakJournal of Molecular Recognition : JMR|March 1, 1996
A technique to study molecular recognition in drug design: preliminary application of free energy derivatives to inhibition of a malarial cysteine proteaseP Cieplak, P A KollmanJournal of Computer-Aided Molecular Design|June 1, 1993
Peptide mimetics as enzyme inhibitors: use of free energy perturbation calculations to evaluate isosteric replacement for amide bonds in a potent HIV protease inhibitorP Cieplak, P A KollmanChemical Physics|April 1, 1996
Interactions of anesthetics with the membrane-water interfaceA Pohorille, P Cieplak, M A WilsonJournal of Biomolecular Structure & Dynamics|April 27, 1999
A modified version of the Cornell et al. force field with improved sugar pucker phases and helical repeatT E Cheatham, P Cieplak, P A KollmanBiopolymers|March 1, 1990
Free energy calculation on base specificity of drug--DNA interactions: application to daunomycin and acridine intercalation into DNAP Cieplak, S N Rao, P D Grootenhuis, et al.Journal of Biomolecular Structure & Dynamics|October 1, 1987
Conformations of duplex structures formed by oligodeoxynucleotides covalently linked to the intercalator 2-methoxy-6-chloro-9-aminoacridineP Cieplak, S N Rao, C Hélène, et al.Oncogenesis|December 4, 2013
A monoclonal antibody interferes with TIMP-2 binding and incapacitates the MMP-2-activating function of multifunctional, pro-tumorigenic MMP-14/MT1-MMPS A Shiryaev, A G Remacle, V S Golubkov, et al.Accounts of Chemical Research|December 22, 2000
Calculating structures and free energies of complex molecules: combining molecular mechanics and continuum modelsP A Kollman, I Massova, C Reyes, et al.Pageof 1