Dear all,
currently I am preparing small molecules for docking purposes with
antechamber and subsequent energy minimization applying sander. The
documentations "Development of a general AMBER force field" of J. Wang
et al. and "Antechamber, an accessory software package for molecular
mechanical calculations" describe basic and special gaff atom types.
However, my current gaff.dat includes only the basic atom types. Will
the special atom types become available in the next time?
Thank you for response!
Merry christmas and a happy new year,
Astrid Maaß
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Received on Wed Jan 14 2004 - 15:53:11 PST
