AMBER Archive (2009)
Subject: [AMBER] Reg. snapshot_statistics.out.snap
From: Rose Tamil (rosetamil26_at_googlemail.com)
Date: Tue Sep 01 2009 - 12:04:08 CDT
Dear Amber users,
I'm running MM-PBSA/GBSA scripts to calculate average binding free energy of
200 snapshots. I also need to calculate interaction energy of each snapshot.
I think these energies will be printed out in the
"snapshot_statistics.out.snap" output file. But when i run the MM-PBSA
script, i couldn't get this output file. Is there anything i need to mention
to get this output file? Could you please tell me how can i get this output
Thanks in advance.
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