Unable to generate topology with graphene - Githubissues

leelasd / ligpargen

A repository for tutorials and FAQ's about LigParGen

http://traken.chem.yale.edu/ligpargen/

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Unable to generate topology with graphene #77

Open layzhaf opened 3 years ago

layzhaf commented 3 years ago

[ ] I believe this to be a bug with LigParGen
[ ] This is a feature request

Issue Information

Software name & Version : Method:

Expected Behavior

Hi, i am having problem generating .itp for my graphene as it says my structure contains more than 1 residues. Can u try look for it? g.pdb.txt

Actual Behavior