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Journal of Molecular Modeling|November 17, 2018
A Feynman dispersion correction: a proof of principle for MNDOMaximilian Kriebel, Konstantin Weber, Timothy ClarkJournal of Molecular Modeling|March 18, 2008
The decomposition of alpha-aminophosphine oxides to phosphonic acid derivatives (PIII)Marek Doskocz, Szczepan Roszak, Roman GancarzJournal of Molecular Modeling|January 15, 2008
Design of benzene-1,2-diamines as selective inducible nitric oxide synthase inhibitors: a combined de novo design and docking analysisSandrea M Francis, Amit Mittal, Manishika Sharma, et al.Journal of Molecular Modeling|February 27, 2008
Vibrational spectral assignments of paraldehyde by ab initio and density functional methodsSethu Gunasekaran, Ramadoss Arunbalaji, Subramanian Kumaresan, et al.Journal of Molecular Modeling|March 5, 2008
Sigma-hole bonding between like atoms; a fallacy of atomic chargesPeter Politzer, Jane S Murray, Monica C ConchaJournal of Molecular Modeling|March 7, 2008
A dynamic view of enzyme catalysisAurora Jiménez, Pere Clapés, Ramon CrehuetJournal of Molecular Modeling|September 6, 2007
Molecular dynamics studies on HIV-1 protease: a comparison of the flap motions between wild type protease and the M46I/G51D double mutantAntonino Lauria, Mario Ippolito, Anna Maria AlmericoJournal of Molecular Modeling|October 6, 2007
Homology modeling and examination of the effect of the D92E mutation on the H5N1 nonstructural protein NS1 effector domainMinyong Li, Binghe WangJournal of Molecular Modeling|July 25, 2006
Probing the nature of hydrogen bonds in DNA base pairsYirong MoJournal of Molecular Modeling|July 3, 2008
Ab initio calculations on the thermodynamic properties of azaborospiropentanesRyan M Richard, David W BallPageof 708