MCPB.py error in step 2 - No Cartesian force constants found?

05 May 2019 1 3K Report

I'm following the MCPB.py tutorial as a protocol for 4 phthalocyanine-like compounds.

All gaussian calculations finished normally, but I can only generate the forcefield parameters for 3 of those 4 compounds.

Does anyone have any ideas as to why I could be getting this error? On JUST this one but not the other molecules? The AMBER mailing list hasn't been super helpful..

Thanks in advance!

Aashish Bhatt

Can you provide input file or better to you send your problem in amber mailing.

also mentioned what exactly error you get?

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