[AMBER] Can we perform combined clustering with multiple prmtop files and mdcrd files?

From: Debarati DasGupta <debarati_dasgupta.hotmail.com>
Date: Fri, 29 Jan 2021 14:36:40 +0000

Hello,

I want to perform clustering of 20 independent trajectories ( the protein backbone is same), the simulations are done in different cosolsvents.

How I can I load in all the prmtops and trajectories in one combined run and cluster them?

Many thanks
Debarati


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Received on Fri Jan 29 2021 - 07:00:02 PST