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Journal of Molecular Modeling|December 4, 2010
Exploring a coarse-grained distributive strategy for finite-difference Poisson-Boltzmann calculationsMeng-Juei Hsieh, Ray LuoJournal of Molecular Modeling|November 26, 2010
Time-dependent density functional theory study of the excited-state dihydrogen bonding: clusters of 2-pyridone with diethylmethylsilane and triethylgermaniumNing-Ning Wei, Ce Hao, Jiao-Jie Tan, et al.Journal of Molecular Modeling|November 3, 2010
Infrared and electronic absorption spectra of n-butyronitrile and its ions using Møller Plesset methodMahadevappa Naganathappa, Ajay ChaudhariJournal of Molecular Modeling|December 17, 2010
Cooperative effect of water molecules in the self-catalyzed neutral hydrolysis of isocyanic acid: a comprehensive theoretical studyXi-Guang Wei, Xiao-Ming Sun, Xiao-Peng Wu, et al.Journal of Molecular Modeling|December 25, 2010
A molecular dynamics study on opioid activities of biphalin moleculeJin-Yuan Hsieh, Tzen-Yuh Chiang, Jun-Liang Chen, et al.Journal of Molecular Modeling|January 14, 2011
AM1 parameters for palladium and silverHakan Kayi, Timothy ClarkJournal of Molecular Modeling|January 4, 2011
The influence of secondary interactions on complex stability and double proton transfer reaction in 2-[1H]-pyridone/2-hydroxypyridine dimersBorys Ośmiałowski, Robert DoboszJournal of Molecular Modeling|January 4, 2011
Quantum chemical studies on the aminopolynitropyrazolesPasupala Ravi, Girish Mohan Gore, Surya Prakash Tewari, et al.Journal of Molecular Modeling|September 8, 2010
Comparative analysis of receptor binding by chicken and human interleukin-1βChao-Sheng Cheng, Wen-Shiang Lu, I-Fan Tu, et al.Journal of Molecular Modeling|September 8, 2010
Theoretical studies on sulfanilamide and derivatives with antibacterial activity: conformational and electronic analysisEsteban G Vega-Hissi, Matías F Andrada, Graciela N Zamarbide, et al.Pageof 696