On Wed, Jul 03, 2019, Charu Sharma (JRF) wrote:
>
>*I want to know how to do minimization of 100 ps and production run for 500
>ps* * for explicit solvent .*
Minimization is measured in steps, not in time units like ps. Looking
at the "Introductory Tutorials" at
http://ambermd.org/tutorials/ is a
good way to get started with Amber.
....dac
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Received on Wed Jul 03 2019 - 11:00:02 PDT
