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Journal of Molecular Graphics & Modelling|November 18, 2005
Simulations of multi-directional forced unfolding of titin I27Rudesh D Toofanny, Philip M WilliamsJournal of Molecular Graphics & Modelling|November 19, 2005
Linear interaction energy models for beta-secretase (BACE) inhibitors: Role of van der Waals, electrostatic, and continuum-solvation termsBrett A Tounge, Ramkumar Rajamani, Ellen W Baxter, et al.Journal of Molecular Graphics & Modelling|December 13, 2005
Wavelet neural network modeling in QSPR for prediction of solubility of 25 anthraquinone dyes at different temperatures and pressures in supercritical carbon dioxideR Tabaraki, T Khayamian, A A EnsafiJournal of Molecular Graphics & Modelling|October 29, 2005
Kinase inhibitor recognition by use of a multivariable QSAR modelD G Sprous, John Zhang, Lei Zhang, et al.Journal of Molecular Graphics & Modelling|November 22, 2005
Cys(x)His(y)-Zn2+ interactions: possibilities and limitations of a simple pairwise force fieldNicolas Calimet, Thomas SimonsonJournal of Molecular Graphics & Modelling|October 26, 2005
Effect of pressure on the conformation of proteins. A molecular dynamics simulation of lysozymeAndrés N McCarthy, J Raúl GrigeraJournal of Molecular Graphics & Modelling|November 14, 2009
The modulation of electronic and optical properties of OXD-X through introduction of the electron-withdrawing groups: a DFT studyL L Liu, X M Pan, W Zheng, et al.Journal of Molecular Graphics & Modelling|August 10, 2000
Stereolithographic models of biopolymersD Yourtee, J Emery, R E Smith, et al.Journal of Molecular Graphics & Modelling|August 10, 2000
A combined QM/MM study of the nucleophilic addition reaction of methanethiolate and N-methylacetamideK Byun, J GaoJournal of Molecular Graphics & Modelling|September 20, 2000
Diffusion of water molecules in crystalline beta-cyclodextrin hydratesK Braesicke, T Steiner, W Saenger, et al.Pageof 401