nahren manuel wrote:
Dear Gromacs Users,
I am presently using gromacs4.5 beta(since I want implicit solvent). I
No need to use a beta version, the official 4.5 has been released.
wish to apply intermolecular distance restraints.
To my surprise there is no merge option in pdb2gmx (although pdb2gnx -h,
says it has). So is there a new alternative to create intermolecular
distance restrains.
Use pdb2gmx -chainsep.
-Justin
Best,
nahren
--
========================================
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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