jalemkul at vt.edu
Thu Jun 20 23:16:29 CEST 2013
On 6/20/13 5:01 PM, Hari Pandey wrote:
> Hi ,
> How do I solve this problem in GROMACS:
> I have a system with 3 part A,B and C
> I have to put thermostat for A and C but not for B.
> Gromacs display error, what is temperature for B.
> How do aI decouple part B
Per the manual:
time constant for coupling (one for each group in tc-grps), -1 means no
Justin A. Lemkul, Ph.D.
Department of Biochemistry
jalemkul[at]vt.edu | (540) 231-9080
More information about the gromacs.org_gmx-users