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Journal of Molecular Modeling|May 7, 2011
On the electronic properties of two-dimensional honeycomb GaInN and GaAlN alloys: a molecular analysisErnesto Chigo Anota, Heriberto Hernández CocoletziJournal of Molecular Modeling|May 5, 2011
In silico investigations of possible routes of assembly of ORF 3a from SARS-CoVHao-Jen Hsu, Wolfgang B FischerJournal of Molecular Modeling|May 5, 2011
Combining molecular dynamics and docking simulations of the cytidine deaminase from Mycobacterium tuberculosis H37RvLuís Fernando Saraiva Macedo Timmers, Rodrigo Gay Ducati, Zilpa Adriana Sánchez-Quitian, et al.Journal of Molecular Modeling|May 12, 2011
An information-carrying and knowledge-producing molecular machine. A Monte-Carlo simulationChristoph KuhnJournal of Molecular Modeling|March 2, 2011
Car-Parrinello and path integral molecular dynamics study of the hydrogen bond in the acetic acid dimer in the gas phasePiotr Durlak, Sławomir Berski, Zdzisław LatajkaJournal of Molecular Modeling|March 2, 2011
Prediction of a new surface binding pocket and evaluation of inhibitors against huntingtin interacting protein 14: an insight using docking studiesShipra Gupta, Gauri Misra, Mohan C Pant, et al.Journal of Molecular Modeling|April 1, 2011
Application of electron conformational-genetic algorithm approach to 1,4-dihydropyridines as calcium channel antagonists: pharmacophore identification and bioactivity predictionNazmiye Geçen, Emin Sarıpınar, Ersin Yanmaz, et al.Journal of Molecular Modeling|April 15, 2011
Computer-assisted design for paracetamol masking bitter taste prodrugsHatem Hejaz, Rafik Karaman, Mustafa KhamisJournal of Molecular Modeling|April 15, 2011
Comparative modeling of UDP-N-acetylmuramoyl-glycyl-D-glutamate-2, 6-diaminopimelate ligase from Mycobacterium leprae and analysis of its binding features through molecular docking studiesAnusuya Shanmugam, Jeyakumar NatarajanJournal of Molecular Modeling|March 30, 2011
Molecular modeling, docking and dynamics simulations of GNA-related lectins for potential prevention of influenza virus (H1N1)Huai-long Xu, Chun-yang Li, Xue-mei He, et al.Pageof 696