Hello Sir,

I want to ask a question about missing residues, for which coordinates are not 
defined in the PDB file.
I have this protein structure and in one of the loop there are some residues 
whose coordinates are not defined in the file.
When I did pdb2gmx for preparing the topology, it joined the end of this loop 
and renumber ed the whole chain there after.
I searched on net and it was written that missing residues should be modelled 
somehow before running simulation, but in my case i cant model this loop having 
missing residues because these are very flexible and i cant define their 
coordinates through modeling,
So, if there is someway through which these residues remain missing and still I 
can go ahead with simulation ?
Thanks in advance.
Regards

--
Sonali Dhindwal

-- 
gmx-users mailing list    gmx-users@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-requ...@gromacs.org.
Can't post? Read http://www.gromacs.org/Support/Mailing_Lists

Reply via email to