共 50 条
- [31] Dynamics of Na+ and Cl- ions solvation in aqueou mixtures of formamide using molecular dynamics simulations. INTERNET JOURNAL OF CHEMISTRY, 1998, 1 (07): : CP1 - U39
- [32] Using the semiclassical initial value representation to add quantum effects to classical molecular dynamics simulations. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2004, 227 : U264 - U264
- [35] Molecular Docking and Molecular Dynamics Simulations of the Kinase Domain Inhibitor for an Epidermal Growth Factor Receptor BULLETIN OF THE KOREAN CHEMICAL SOCIETY, 2013, 34 (08): : 2515 - 2518
- [36] Solvation and axial coordination in sterically constrained complexes: Molecular dynamics simulations. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 1998, 216 : U153 - U153
- [37] Calculation of the electron transfer reorganization energy from molecular dynamics simulations. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2003, 226 : U174 - U174
- [38] Characterizing the Autonomous Motions of Linear Catalytic Nanomotors Using Molecular Dynamics Simulations JOURNAL OF PHYSICAL CHEMISTRY C, 2011, 115 (40): : 19588 - 19597
- [39] Ice-binding mechanism of the antifreeze protein by molecular dynamics simulations. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 1996, 211 : 242 - PHYS
- [40] DFT Study on mechanochemical bond breaking in COGEF and Molecular Dynamics simulations. PROCEEDINGS OF THE INTERNATIONAL CONFERENCE ON COMPUTATIONAL SCIENCE (ICCS), 2011, 4 : 1167 - 1176