[gmx-users] Simulation of Glass Surfaces?
ajlanphere at gmail.com
Wed Aug 6 16:29:30 CEST 2014
I suppose I should have mentioned I'm using Gromacs 4.6.5. That section of
the manual covers angular restraints, is that where I should be reading?
Sorry for asking potentially inane questions, I'm not very experienced with
this sort of thing.
On Wed, Aug 6, 2014 at 10:18 AM, Justin Lemkul <jalemkul at vt.edu> wrote:
> On 8/6/14, 8:01 AM, AJ Lanphere wrote:
>> Thank you for the information that does sound like it would do what I'm
>> looking for, but could you possibly elaborate on how to set that up? I
>> don't see either of those terms in the manual, either under the run
>> parameters section about walls or otherwise.
> Manual section 4.3.2 and Table 5.5.
> Justin A. Lemkul, Ph.D.
> Ruth L. Kirschstein NRSA Postdoctoral Fellow
> Department of Pharmaceutical Sciences
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