João M. Damas

+1

+1. This would be deeply appreciated!

I think it's an issue that plagues many public projects. There's only enough time to dedicate to them and many times more people asking for features than becoming involved in...

As per discussed with @loriab in https://github.com/psi4/psi4/issues/933, it would be interesting to have a Windows native compilation for psi4

Thanks a lot for the feedback! I guess that for now I'll micro-wiggle around my initial coordinates a bit and that should fix it, right?

Thanks @loriab!

HI @loriab, I'm still having this issue with psi 1.2 (the released, not the dev one) It's quite erratic - sometimes it works, sometimes it doesn't. I was trying to...

I apologize, maybe I'm fiddling with something different that leads to the same error message. Perhaps it's better to keep the 100% reproducible case. My point was that it was...

Niggling side issue, so don't worry. If it becomes frequent, I'll report.

Hi @n-salvi, I recently made a PR that solved that issue: https://github.com/Acellera/htmd/issues/594 That PR included changes that override Amber default paths. Check the new `amber.build` argument `teleapimports`: https://github.com/Acellera/htmd/blob/master/htmd/builder/amber.py#L220 If it...