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[ESPResSo-users] Energy minimization at C level

From: Lei Liu
Subject: [ESPResSo-users] Energy minimization at C level
Date: Thu, 17 Jan 2013 16:07:00 +0100

Dear all,

I need to do lots of energy minimization with Espresso at the moment.

Dose anyone has experience in implementing energy minimization functionality,
with whatever method (e.g. deepest descent), in the core of Espresso ?
It is best not at the TCL interface level, because I hope it is faster.

Any advice would be much appreciated.

Best regards
Lei Liu

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