共 50 条
- [1] Effective Fragment Molecular Orbital Method: A Merger of the Effective Fragment Potential and Fragment Molecular Orbital MethodsJOURNAL OF PHYSICAL CHEMISTRY A, 2010, 114 (33): : 8705 - 8712Steinmann, CasperFedorov, Dmitri G.Jensen, Jan H.
- [2] Recent advances and applications of the Fragment Molecular Orbital method (FMO) in biomolecular computationEUROPEAN BIOPHYSICS JOURNAL WITH BIOPHYSICS LETTERS, 2005, 34 (06): : 738 - 738不详
- [4] Development of the Fragment Molecular Orbital Method for Calculating Nonlocal Excitations in Large Molecular SystemsJOURNAL OF PHYSICAL CHEMISTRY A, 2018, 122 (15): : 3886 - 3898Fujita, TakatoshiMochizuki, Yuji
- [5] Definition of molecular orbitals in fragment molecular orbital methodCHEMICAL PHYSICS LETTERS, 2002, 364 (1-2) : 139 - 143Inadomi, YNakano, TKitaura, KNagashima, U
- [6] Polarization energies in the fragment molecular orbital methodJOURNAL OF COMPUTATIONAL CHEMISTRY, 2022, 43 (16) : 1094 - 1103Fedorov, Dmitri G.
- [7] Exploring chemistry with the fragment molecular orbital methodPHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2012, 14 (21) : 7562 - 7577Fedorov, Dmitri G.Nagata, TakeshiKitaura, Kazuo
- [8] Acceleration of fragment molecular orbital method with GPUsABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2011, 241Koga, RyotaFurukawa, YukiYasuda, Koji
- [9] Fragment molecular orbital method: application to polypeptidesCHEMICAL PHYSICS LETTERS, 2000, 318 (06) : 614 - 618Nakano, TKaminuma, TSato, TAkiyama, YUebayasi, MKitaura, K
- [10] Calculations of large molecular systems with the fragment molecular orbital methodABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2010, 239Fedorov, Dmitri G.Kitaura, Kazuo