[gmx-users] Re: gmx-users Digest, Vol 52, Issue 78

Vitaly Chaban chaban at univer.kharkov.ua
Tue Aug 19 12:47:48 CEST 2008


> I have already included the dmso.itp file.still I am getting the error
> atom type SD not found
> thanx in advance for helping me

So everything should work. Either you didn't include corresponding
topology or you included something else to conflict.

Start your pursue from the very beginning. Types in .gro and .top must
be consistent.


-- 
Vitaly V. Chaban
School of Chemistry
National University of Kharkiv
Svoboda sq., 4, Kharkiv 61077, Ukraine
email: chaban at univer.kharkov.ua
skype: vvchaban



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