[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


      
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20100917/2722583a/attachment.html>


More information about the gromacs.org_gmx-users mailing list