From: Gaurav Sharma (sharma_at_coe.neu.edu)
Date: Sun Feb 13 2005 - 18:14:31 CST
I used the psfgen's patch command to protonate GLU, ASPs to study the
effect of lower pH.
Is there a similar patch command to un-protonate the GLU, ASP in the
final structure obtained from the above simulation in order to study the
reversibility of the reaction.
Thanks in advance,
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