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Journal of Molecular Graphics & Modelling|September 15, 2004
Computational analysis of tyrosine phosphatase inhibitor selectivity for the virulence factors YopH and SptPXin Hu, Milos Vujanac, C Erec Stebbins
Journal of Molecular Graphics & Modelling|November 2, 2005
Structure-based drug design to the discovery of new 2-aminothiazole CDK2 inhibitorsAnna Vulpetti, Elena Casale, Fulvia Roletto, et al.
Journal of Molecular Graphics & Modelling|October 26, 2005
A reactivity index study to rationalize the effect of dopants on Brönsted and Lewis acidity occurring in MeAlPOsAbhijit Chatterjee
Journal of Molecular Graphics & Modelling|November 1, 2005
Homology modelling and protein structure based functional analysis of five cucumovirus coat proteinsAkos Gellért, Katalin Salánki, Gábor Náray-Szabó, et al.
Journal of Molecular Graphics & Modelling|October 14, 2005
Clustering of domains of functionally related enzymes in the interaction database PRECISE by the generation of primary sequence patternsMelissa R Landon, David R Lancia, Karl H Clodfelter, et al.
Journal of Molecular Graphics & Modelling|March 12, 2002
Differential binding mode of diverse cyclooxygenase inhibitorsOriol Llorens, Juan J Perez, Albert Palomer, et al.
Journal of Molecular Graphics & Modelling|December 14, 2005
The hydration structure of 18-crown-6/K+ complex as studied by Monte Carlo simulation using ab initio fitted potentialSriprajak Krongsuk, Teerakiat Kerdcharoen, Supot Hannongbua
Journal of Molecular Graphics & Modelling|February 5, 2010
Computed NMR shielding increments over benzo-analogs of unsaturated five-membered ring heterocyclic compounds as a measure of aromaticityNed H Martin, Jimmy E Rowe, Eddie LaReece Pittman
Journal of Molecular Graphics & Modelling|December 22, 2005
Molecular basis for the enantioselective binding of a novel class of cytochrome bc1 complex inhibitorsYa-Jun Zheng
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