Mark, please don't be one of those people telling young researchers that
everything has already been done. :)
My postdoc (a fellow, actually -- with her own project & funding) is
reading all these horrible papers and, according to her, everything has
been done. Drives me nuts!
Alex
On 5/28/2018 1:11 AM, Mark Abraham wrote:
Hi,
I found a couple of papers doing MD on colchicine and tubulin in a few
minutes on Google - maybe you should start there and also check your work
will be novel :-)
Mark
On Sat, May 26, 2018 at 8:00 AM Harutyun Sahakyan <sahakya...@gmail.com>
wrote:
Hi all,
I use gromacs for MD simulations, but use charmm or amber force fields, did
someone try to generate the colchicine topology? I try to do it using
CGenFF, but get to high penalty score due to dihedrals. And which force
field is better for protein-ligand simulation (tubulin-colchicine)?
Thank you in advance,
Harut
--
Gromacs Users mailing list
* Please search the archive at
http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before
posting!
* Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
* For (un)subscribe requests visit
https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or
send a mail to gmx-users-requ...@gromacs.org.
--
Gromacs Users mailing list
* Please search the archive at
http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting!
* Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
* For (un)subscribe requests visit
https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a
mail to gmx-users-requ...@gromacs.org.