AMBER Archive (2003)

Subject: free energy calculations

From: Joseph Fernandez (joefern9999_at_yahoo.com)
Date: Fri Apr 04 2003 - 15:18:25 CST


Hi,
  Are there any issues to consider when carrying out
free energy perturbation calculation for mutation of
methyl group to charged amino group using Gibbs?

thanks, Joe.

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