@pythonf.bsky.social
📤 11
📥 55
📝 4
🔥 Embarrassingly parallel, embarrassingly simple! 🚀 Swap out tqdm for Laufband and scale across as many SLURM jobs as you want. No complicated code changes, just results! 👉
github.com/zincware/lau...
5 months ago
0
0
0
Finally got around to updating the ZnTrack docs—took me way too long, but here we are! 🚀 Check them out
zntrack.readthedocs.io/en/latest/
loading . . .
ZnTrackContentsMenuExpandLight modeDark modeAuto light/dark, in light modeAuto light/dark, in dark mode
https://zntrack.readthedocs.io/en/latest/
8 months ago
0
0
0
reposted by
Andrew S. Rosen
10 months ago
Very useful looking Python package by BASF on evaluating MLIPs!
github.com/basf/mlipx
loading . . .
GitHub - basf/mlipx: Machine-Learned Interatomic Potential eXploration (mlipx) is designed at BASF for evaluating machine-learned interatomic potentials (MLIPs). It offers a growing set of evaluation ...
Machine-Learned Interatomic Potential eXploration (mlipx) is designed at BASF for evaluating machine-learned interatomic potentials (MLIPs). It offers a growing set of evaluation methods alongside ...
https://github.com/basf/mlipx
1
27
6
Want to build a Christmas tree out of molecules? Checkout my first entry for
#AdventOfCode
using
#ZnDraw
- find out how at
zndraw.readthedocs.io/en/latest/20...
@unistuttgart.bsky.social
10 months ago
0
2
0
you reached the end!!
feeds!
log in
