GROMACS version: 2019
GROMACS modification: Yes/No
ERROR 1 [file lig.itp, line 363]:
No default Proper Dih. types
I am using Charmm36-mar 2019 ff for protein ligand complex, cgenff server used to generate the ligand topology. while generate ions.tpr i got the following error. how to solve this
ERROR 2 [file lig.itp, line 370]:
No default Proper Dih. types
ERROR 3 [file lig.itp, line 390]:
No default Proper Dih. types
ERROR 4 [file lig.itp, line 414]:
No default Proper Dih. types
ERROR 5 [file lig.itp, line 494]:
No default Proper Dih. types
Excluding 3 bonded neighbours molecule type ‘Protein_chain_P’
Excluding 3 bonded neighbours molecule type ‘lig’
Excluding 2 bonded neighbours molecule type ‘SOL’