[gmx-users] RE:Re: clear orientation during MD (David van der Spoel)

Rongliang Wu wurl04 at iccas.ac.cn
Fri Dec 16 14:54:04 CET 2005


Hello gmx-users,
       no, i coupled the whole system. why should it freeze if i couple the whole system? is it reasonable?
       will it change the system so that they cannot fit each other if i couple them seperately? my system is an interface formed with water and decane periodic boxes 	

Thanks!

Regards!
                    
Sincerely,

Rongliang Wu
State Key Laboratory
of Polymer Physics and Chemistry
Center of Molecular Science
Institute of Chemistry
Chinese Academy of Sciences
 				

          wurl04 at iccas.ac.cn
          2005-12-16


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