#792 Added recognition of MOPAC 2007, 2009 and 2012 output files.

[Oliver Stueker]

Hi,
I have added recognition of MOPAC 2007, 2009 and 2012 output files to the cdk-ioformats module simply by using the MOPAC2002Format.java and MOPAC2002FormatTest.java files as a template.

I hope that this patch can make it into the next release.

Cheers,
Oliver

see at: https://github.com/cdk/cdk/pull/36
or: https://github.com/ostueker/cdk/tree/mopacFormats

[John May]

Hi Oliver,

Thanks for the patch. I’ve left some comments on the commit. Could you amend/add the following and I’ll pull it into master.

1. Copyright needs updating
2. Unit test for each matches implementation
3. Cleaner ‘matches()’ method [optional]

Thanks,
John

[John May]

Applied and pushed.