About the nonbonded parameters

From: Lu <zhonglu_at_uni-wuppertal.de>
Date: Thu 28 Oct 1999 19:20:59 +0200

Hi, friends:
  Can anyone tell me the meaning of STDA and STUB in the nonbonded
parameters section of parm91.dat?
I want to use united atom model of Carbon, there are two choices of
nonbonded parameters in parm91.dat: STDA and STUB. I don't know which
one is suitable for hydrocarbonate calculations.
  Thank you very much!
  Best regards
  Zhongyuan Lu
Received on Thu Oct 28 1999 - 10:20:59 PDT
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