Re: [gmx-users] RE: gmx-users Digest, Vol 66, Issue 124

2009-10-19 Thread Justin A. Lemkul
Thielges, Sabine wrote: Thielges, Sabine wrote: Hi everyone, I am currently doing a simulation which involves a dopamine receptor placed in a POPC membrane and an agonist or antagonist in the active site. The ligand was placed by VS and is closed to what the biology gives. My problem is th

[gmx-users] RE: gmx-users Digest, Vol 66, Issue 124

2009-10-19 Thread Thielges, Sabine
Thielges, Sabine wrote: >> Hi everyone, >> >> I am currently doing a simulation which involves a dopamine receptor >> placed in a POPC membrane and an agonist or antagonist in the active >> site. The ligand was placed by VS and is closed to what the biology >> gives. My problem is that the liga