INFORMATION GLEANED FROM INTERNET
- Charge fitting philosophy (by W. Cornell),
- RESP program & RESP FAQ (AMBER Web site),
- Determining atomic charges using the Merz-Singh-Kollman Scheme and CHELPG (by H. Zipse),
- Howto... (by U. Ryde),
- RESP & ESP charges in NWChem,
- The Pdm97 program (by D.E. Williams),
- The Fitcharge program (belongs to the CHARMM suite of program),
- The Antechamber program (belongs to the AMBER suite of program),
- Calculation of ESP charges with Molden (G. Schaftenaar, CMBI, the Netherlands).
- ESP charges in AMPAC.
To be completed...
Last update of this R.E.D. web page: July 1st, 2010
Université de Picardie Jules Verne - Sanford Burnham Prebys Medical Discovery Institute.
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