[AMBER] residuewise energy decomposition in Amber

From: <moitrayee.mbu.iisc.ernet.in>
Date: Tue, 9 Aug 2011 11:50:29 +0530 (IST)

Dear Amber Users,

I am performing the residue-wise energy decomposition in Amber using mm-pbsa
module. The outputs are for TDC, SDC, and BDC. Is it possible that I only write
out TDC in the output file *_com.all.out. This is because the file size becomes
too large if I print all.

Any suggestions regarding this will be highly appreciated.

Thanks a lot in advance.

Best Regards,
Moitrayee 





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Received on Mon Aug 08 2011 - 23:30:03 PDT
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