Re: [Open Babel] Python scripts, Open Babel and SMOG output

On 6/19/2020 11:16 AM, C Anthony Lewis wrote: ... File "smog.py", line 16, in smog2mol atm.SetAtomicNum(ob.cvar.etab.GetAtomicNum(element)) AttributeError: Unknown C global variable 'etab' ob.cvar.etab.GetAtomicNum(element) looks like you're trying to access the element table via some

[Open Babel] Python scripts, Open Babel and SMOG output

Dear Colleagues, I hope you are all safe and well at this extraordinary time. This is a follow-up to messages I sent to the list in late 2013 and early 2014 regarding an old DOS-based program 'SMOG' (see CCL archives http://www.ccl.net/cca/software/MS-DOS/SMOG/index.shtml and http://pubs.acs.o