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Journal of Molecular Graphics & Modelling|October 20, 2012
Binding pattern of the long acting neuraminidase inhibitor laninamivir towards influenza A subtypes H5N1 and pandemic H1N1Arthitaya Meeprasert, Wasinee Khuntawee, Kittiwat Kamlungsua, et al.Journal of Molecular Graphics & Modelling|October 23, 2012
Phase transition study of confined water molecules inside carbon nanotubes: hierarchical multiscale method from molecular dynamics simulation to ab initio calculationSoheila Javadian, Fariba Taghavi, Faramarz Yari, et al.Journal of Molecular Graphics & Modelling|October 23, 2012
Substituent effects on zinc phthalocyanine derivatives: a theoretical calculation and screening of sensitizer candidates for dye-sensitized solar cellsLinlin Yang, Lianshun Guo, Qianqian Chen, et al.Journal of Molecular Graphics & Modelling|October 23, 2012
Quantitative structure-activity relationships (QSARs) using the novel marine algal toxicity data of phenolsM Doğa Ertürk, Melek Türker Saçan, Marjana Novic, et al.Journal of Molecular Graphics & Modelling|October 23, 2012
Novel descriptors from main and side chains of high-molecular-weight polymers applied to prediction of glass transition temperaturesDamián Palomba, Gustavo Esteban Vazquez, Mónica Fátima DíazJournal of Molecular Graphics & Modelling|October 23, 2012
Coupled motions during dynamics reveal a tunnel toward the active site regulated by the N-terminal α-helix in an acylaminoacyl peptidaseElena Papaleo, Giulia RenzettiJournal of Molecular Graphics & Modelling|October 23, 2012
Targeting essential cell wall lipase Rv3802c for potential therapeutics against tuberculosisParameswaran Saravanan, Hindupur Avinash, Vikash Kumar Dubey, et al.Journal of Molecular Graphics & Modelling|October 23, 2012
Computational study: how redox affect the nonlinear optical properties of donor substituted heteroleptic bis-tridentate Ru(II) complexes?Xiu-Xin Sun, Na-Na Ma, Xiao-Juan Li, et al.Journal of Molecular Graphics & Modelling|October 23, 2012
A theoretical study of structural and electronic properties of pentacene/Al(100) interfaceG Saranya, Shiny Nair, V Natarajan, et al.Journal of Molecular Graphics & Modelling|October 23, 2012
Identification of structural determinants of ligand selectivity in 5-HT₂ receptor subtypes on the basis of protein-ligand interactionsJae Wan Jang, Min Sup Kim, Yong Seo Cho, et al.Pageof 408