[gmx-users] CMAP for alanine dipeptide in Charmm27 ff

César Ávila clavila at gmail.com
Sat Oct 8 18:07:19 CEST 2011

I would like to run REMD simulations on the alanine dipeptide using the
Charmm27ff + CMAP. Still, after processing the pdb with pdb2gmx, I do not
see any entrance referring to the cmap term in the topology file. Does this
mean that Cmap won't be calculated?
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20111008/26b1ad4d/attachment.html>

More information about the gromacs.org_gmx-users mailing list