[AMBER] Merge cpout files to analyze full simulation

From: Abdelrahman, Noureen via AMBER <amber.ambermd.org>
Date: Mon, 20 May 2024 13:09:35 +0000

Hello everyone,

I was running a pH-REMD simulation that timed out, and I restarted it using the updated coordinates and cpin files. Now, I have two sets of cpout files that I need to merge for each pH to start my analysis. However, it doesn't seem that cphstats has a merge option. What is the best way to merge my cpout files to analyze the full simulation?

Thank you,
Noureen
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Received on Mon May 20 2024 - 06:30:02 PDT
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