I verified the names in the .gro files: all the names are OK!
I also verified a C=C bond distance (within an aromatic cycle) and it is = 3.67
(I took a PDB file used to generate this model and which contain the THF, the
distance between the same atoms were 1,43!!)
Zeineb
--
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.
