Fragment molecular orbital method: analytical energy gradients
- 1 March 2001
- journal article
- research article
- Published by Elsevier in Chemical Physics Letters
- Vol. 336 (1-2) , 163-170
- https://doi.org/10.1016/s0009-2614(01)00099-9
Abstract
No abstract availableKeywords
Funding Information
- Ministry of Education (12640501)
This publication has 4 references indexed in Scilit:
- Fragment molecular orbital method: application to polypeptidesChemical Physics Letters, 2000
- Fragment molecular orbital method: an approximate computational method for large moleculesChemical Physics Letters, 1999
- Pair interaction molecular orbital method: an approximate computational method for molecular interactionsChemical Physics Letters, 1999
- Natural population analysisThe Journal of Chemical Physics, 1985