Daniel Hollas

Are you on Windows? I think you need to launch fprettify from a command line, not from Python prompt.

@pseewald friendly ping. :blush: LMK if you want me to split this PR into smaller pieces to make it easier to review.

I just ran into this as well. The fix looks good to me. It would be nice to have a test for this, maybe extending / modifying this test case:...

@tclune thanks for tagging me, happy to be a (very little) contributor. :-) Just want to double check: do we really need to send the signed CLA in paper form?...

++ on the idea, adding tests manually to the Makefile is not super ergonomic.

Just noting here that GCC-7 compilation started to fail with internal compiler error when compiling fArgParse (which was apparently updated via submodule in this repo 7 days ago). ``` internal...

@tclune no worries and thanks for the reply. GCC-7 works as long as the new fhamcrest functionality is disabled (via cmake config `-DSKIP_FHAMCREST=YES`). We're using that version as that is...

@andre-cloud which cclib version are you using? Support for ORCA 5.0 has been merged to the master branch, but not officially released yet. Using master branch I can parse frequency...

@awvwgk I am very interested in this feature, is it still in the cards for this project? If so, I could take a swing at it, although I am unfamiliar...

Thanks for working on this! I spent quite some time banging my hand against this restriction. :face_with_head_bandage: > Hey @sphuber do you have a specific use case in mind for...