Re: [AMBER] Residue wise energy decomposition via MM-PBSA

From: Elvis Martis <elvis.martis.bcp.edu.in>
Date: Wed, 6 Sep 2017 06:37:16 +0000

HI,
You can import this in MS-EXCEL and you will be able to see it properly.

Best Regards
Elvis Martis
Mumbai, INDIA.

________________________________________
From: Rajarshi Roy <phd1701171011.iiti.ac.in>
Sent: 05 September 2017 09:36
To: AMBER Mailing List
Subject: [AMBER] Residue wise energy decomposition via MM-PBSA

Dear amber users and developers,

I am running AMBER 16. I was trying to calculate decomposition of binding
energy per residue via MM-PBSA scheme. But the format of my output file
i.e. FINAL_DECOMP_MMPBSA.dat is quite different and it is very difficult to
handle or manage that data.
Can anyone please tell me how to handle this kind of data.
I attached my output.dat file and one screen shot of my terminal below,

--
with regards
Rajarshi Roy
PhD Research Scholar
Biosciences and Biomedical Engineering
Indian Institute of Technology, Indore
India
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Received on Wed Sep 06 2017 - 00:00:03 PDT
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