Dear Amber Users,
I am trying to calculate the RESP charges of a small molecule using antechamber. Before using antechamber I minimised this molecule using Gaussian09 and then I have calculted with the same software a grid in order calculate the charges with Antechamber, but I got this error:
"No atom read in, the gaussian output file may not complete, exit”.
The strange thing is that I made the same procedure with different molecules and everything went well, namely I calculated the charges.I tried to change the grid in the gaussian input file, but it doesn’t work. Somebody could help me?
Best Regards
Luca maggi
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Received on Tue Mar 21 2017 - 00:00:03 PDT
