[AMBER] MD simulation at 1M or 2M salt concentration

From: 张后今 <hjzhang.hust.edu.cn>
Date: Sun, 28 Sep 2014 09:59:03 +0800 (GMT+08:00)

Hi, guys:


I would like to do simulation with a halophilic enzyme. The optimal salt concentration for this protein is 2M salt. Is Amber suitable for this kind of work? I am not sure if the force fields have been tested at such high salt concentration.


Thank you very much in advance !!


Dr Eugene Zhang
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Received on Sat Sep 27 2014 - 19:00:02 PDT