subject:"\[gmx\-users\] X\-ray Structures"

Re: [gmx-users] X-ray Structures

2011-05-19 Thread Mark Abraham

On 20/05/2011 7:38 AM, simon sham wrote: Hi, I have a question about using X-ray PDB files for simulations: 1. Is there any rule of thumb on how good a resolution is required for simulations? Not really. The lower the resolution, the more likely that the initial conditions for the simulatio

[gmx-users] X-ray Structures

2011-05-19 Thread simon sham

Hi, I have a question about using X-ray PDB files for simulations: 1. Is there any rule of thumb on how good a resolution is required for simulations? I know it has nothing to do with GROMACS. Thanks for your insight. Simon -- gmx-users mailing listgmx-users@gromacs.org http://lists.gromac