[gmx-users] ambconv again
brucedray at yahoo.com
Sat Mar 15 00:35:19 CET 2008
--- Alan <alanwilter at gmail.com> wrote:
> Hi list!
> I gave a good look at GMX mailing-list but I
> definitely couldn't get ambconv
> (from GMX website) working. I try the patch and I
> still get "Segmentation
> I am using antechamber 1.27.
> Is there any kind soul with this ambconv package
> fixed for Linux and working
> with antechamber 1.27? I don't have amber and I am
> not talking about the
> perl version ambconv.pl.
> Could it be uploaded at GMX contribution session?
> The ambconv there is from
> 2002 and definitely doesn't work anymore.
I've attached the version of ambconv I use. It works
on Mac OS X 10.3.9.
I've not tried it on Linux, but it should work for
After I got ambconv to work, I was not happy with the
sybyl mol2 files. Therefore, I wrote topolbuild to
give me a gromacs
Bruce D. Ray, Ph.D.
Associate Scientist, and Operations Director
402 N. Blackford St.
Indianapolis, IN 46202-3273
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