James Schloss
James Schloss
https://github.com/EnzymeAD/Enzyme/pull/849 (I didn't write the PR) Looks promising! I'll chat with a few other folks tomorrow about how to easily test things in Julia. I think we need to wait...
I think the most important thing is that we are able to import a bibtex file (just a general literature.bib for everything in some directory somewhere is fine). Jekyll scholar...
In principle, the PR runs now, but I am getting some scalar indexing in the tests somewhere that I need to fix. I've been noticing scalar indexing in other Molly...
``` accumulateadd(x) = accumulate(+, x) # Accumulate values in an array based on the ordered boundaries in bounds # Used to speed up views with repeated indices on the GPU...
Since the code runs, but tests are not quite passing, I think it's best to keep this PR open and refactor it into a KernelAbstractions PR on top of the...
Woops, that's completely my bad. Sorry for the random issue then!
I was just testing this on a P100 with 16 GB of available RAM and ran into a related issue: ``` OpenMM protein comparison: Error During Test at /home/leios/projects/CESMIX/Molly.jl/test/protein.jl:57 Got...
Yeah, that's fair. I'll just quietly comment out the test for now for #99
Great! Thanks for the clarification!
Alright, working with the code now, I found 3 errors: 1. There was a problem with the `sqrt` function for some reason