Re: [gmx-users] DPOSRE not restraining

2012-07-28 Thread Justin Lemkul
On 7/28/12 1:49 PM, tarak karmakar wrote: Dear All , I wanted to keep all the molecules other than water fixed [ positiion restraints]. So for that I have performed short NVT [simulation with DEPOSRE] after minimization, but while seeing the movie of the trajectory in VMD I see the protei

[gmx-users] DPOSRE not restraining

2012-07-28 Thread tarak karmakar
Dear All , I wanted to keep all the molecules other than water fixed [ positiion restraints]. So for that I have performed short NVT [simulation with DEPOSRE] after minimization, but while seeing the movie of the trajectory in VMD I see the protein backbone is moving. So did I miss somethi