[gmx-users] how to build xtc file from many same crystal structures which are different conformational states.

xi zhao zhaoxiitc2002 at yahoo.com.cn
Thu Dec 13 03:29:52 CET 2012



Dear gmx-users:
 I want to analysis PCA for many crystal strcutures, comparing with MD trajectories, but how to build xtc file from many same structures whchi are different conforamtional states.

thank you 

best regards!

 



More information about the gromacs.org_gmx-users mailing list