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Journal of Molecular Graphics & Modelling|October 12, 2007
Exploring QSTR and toxicophore of hERG K+ channel blockers using GFA and HypoGen techniquesDivita Garg, Tamanna Gandhi, C Gopi MohanJournal of Molecular Graphics & Modelling|August 21, 2007
Pharmacophore modeling and virtual screening studies to design some potential histone deacetylase inhibitors as new leadsS Vadivelan, B N Sinha, G Rambabu, et al.Journal of Molecular Graphics & Modelling|August 11, 2007
Comparative QSTR studies for predicting mutagenicity of nitro compoundsPramod C Nair, M Elizabeth SobhiaJournal of Molecular Graphics & Modelling|August 19, 2007
Prediction of protein-ligand complex structure by docking software guided by other complex structuresYoshifumi Fukunishi, Haruki NakamuraJournal of Molecular Graphics & Modelling|November 27, 2007
In silico screening against wild-type and mutant Plasmodium falciparum dihydrofolate reductaseGary B Fogel, Mars Cheung, Eric Pittman, et al.Journal of Molecular Graphics & Modelling|November 21, 2007
Catalytic mechanism of l,l-diaminopimelic acid with diaminopimelate epimerase by molecular docking simulationsL Brunetti, R Galeazzi, M Orena, et al.Journal of Molecular Graphics & Modelling|January 9, 2007
QSAR study of a large set of 3-pyridyl ethers as ligands of the alpha4beta2 nicotinic acetylcholine receptorHuabei Zhang, Hua Li, Qinqin MaJournal of Molecular Graphics & Modelling|February 24, 2007
I-SOLV: a new surface-based empirical model for computing solvation free energiesRenxiao Wang, Fu Lin, Yong Xu, et al.Journal of Molecular Graphics & Modelling|February 27, 2007
DFT study on the structures and properties of 3-nitro-1,2,4-triazol-5-one crystals at high pressureLina Xu, Guoyong Fang, Xinhua Li, et al.Journal of Molecular Graphics & Modelling|March 23, 2007
A simple method to calculate the accessible volume of protein-bound ligands: application for ligand selectivityErlend Hodneland, Knut TeigenPageof 402