[gmx-users] Charmm Sugars/carbohydrates
Andrew Paluch
apaluch at nd.edu
Wed Dec 7 19:29:15 CET 2011
All of the Charmm force field parameters may be found on Alex
MacKerell's website: http://mackerell.umaryland.edu/
CHARMM_ff_params.html. Converting from Charmm units and potential
form to Gromacs is straightforward.
Andrew
On Dec 7, 2011, at 12:59 PM, Michael McGovern wrote:
> Hi everyone. I'm doing a simulation in gromacs using the charmm36
> parameters from the gromacs website. The parameters don't seem to
> have carbohydrates, which are part of the charmm36 force field. In
> particular, I need parameters for trehalose. Is there anywhere I
> can find these parameters in a format suitable for gromacs?
> --
> gmx-users mailing list gmx-users at gromacs.org
> http://lists.gromacs.org/mailman/listinfo/gmx-users
> Please search the archive at http://www.gromacs.org/Support/
> Mailing_Lists/Search before posting!
> Please don't post (un)subscribe requests to the list. Use the
> www interface or send it to gmx-users-request at gromacs.org.
> Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20111207/1e974b1d/attachment.html>
More information about the gromacs.org_gmx-users
mailing list