[gmx-users] Protein ligand simulation
DEEPANSHU SINGLA
deepanshusingla99 at gmail.com
Tue Oct 1 09:39:23 CEST 2019
I am trying to learn protein ligand simulation. I tried to follow the steps
for lysozyme using the GROMACS tutorial. I received the following error:
*ERROR 1 {file jz4.itp, line 183]:*
* No default Proper Dih. types*
*ERROR 2 [file jz4.itp, line 194]:*
* No default Proper Dih. types*
*Fatal error: *
*Syntax error -File forcefield.itp, line 10*
*Last line resd:*
*'[defaults]'*
*Invalid order for directive defaults*
Please help me resolve this error.
Thanking you in advance.
Deepanshu Singla
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