[AMBER] problem with MM-PBSA

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From: Maryam Hamzehee <maryam_h_7860.yahoo.com>
Date: Tue, 6 Sep 2011 16:55:41 +0800 (SGT)

Dear Amber List,

I am running python version of MM-PBSA for my Ligand-receptor complex. The FINAL_RESULTS_MMPBSA.dat is produced successfuly. Among the output files there is a file which has been attached to email named "binding_energy.pbs.e112". I was wondering if you could kindly have a look to that file and let me know whether there is a problem in calculation with it or not. Can I ignore it?

Any help would be highly appreciated!

Cheers,
Maryam

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text/plain attachment: binding_energy.pbs.e112

Received on Tue Sep 06 2011 - 02:00:03 PDT