[AMBER] Input Reservoir REMD

From: Raimon Fabregat <raimon.fabregat.epfl.ch>
Date: Tue, 19 Mar 2019 09:17:13 +0100

Dear all,

I have a working standard REMD simulation, and I want to replace the
highest temperature by a 'reservoir'. I have followed the instructions
in the AMBER manual, but I haven't been able to understand how the input
files should be modified. Has any of you some working input files that I
could use as a guide?

Thanks a lot for your help.

Best,

Raimon


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Received on Tue Mar 19 2019 - 01:30:02 PDT
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