News
News

\(drf90\)

classical-only part of the Direct (or Discrete) Reaction Field (DRF) approach
Current version: 2012.01 (shared with CC-BY-NC license). See also all python tools and the drf90 pages.

Molecular mechanics parameters

to be updated soon
MECH block/namelist for Molecular Mechanics parameters
The AMBER95 intramolecular Force Field is implemented.