[gmx-users] grompp error
محمد گره گشا
m.gerehgosha at gmail.com
Sun Oct 18 09:06:39 CEST 2015
we doing MD by oplsa ff for protein-ligand complex that we take from
Autodock. we do this steps to add ligand as a residue at residue database,
but when run grompp we face this error
ERROR 1 [ file LIG.itp, line 401 ]:
No default proper Dih. types
There was 1 error in input file(s)
can you help we please?
so thank you.
We attached LIG.itp
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