tekle...@ualberta.ca wrote:
Dear Gromas users,
I want to run another set of MD simulation of my polymer in a mixed
solvent.
step 1
24 polymer molecules in a 10 * 10 * 10 nm of box.
step 2
I want to add 50% (v/v) of two solvents to this box. I have already done
an MD simulation with their individual solvents, now I want to run those
polymers in their mixture.
Please suggest?
http://www.gromacs.org/Documentation/How-tos/Mixed_Solvents
-Justin
Rob
--
========================================
Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
MILES-IGERT Trainee
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin
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