[gmx-users] about NPT run

zhongjin zhongjin1000 at yahoo.com.cn
Fri Sep 17 03:11:06 CEST 2010

Hi,    I want to run a NPT run,could I put some groups into position restraint, or make them frozened ?    I find it is OK in NVT ensemble. But I am not sure whether it is proper.    Thanks!Zhongjin He

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