[AMBER] how to obtain index of atoms based on residue and atom masks

From: Ming Tang <m21.tang.qut.edu.au>
Date: Wed, 19 Jan 2022 01:01:41 +0000

Dear list,

Is there a command to print out atom indexes (separated by comma) for a large number of residues? I want to use them as cv_i in ABMD.

Thanks,
Tammy
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Received on Tue Jan 18 2022 - 17:30:02 PST