8 projects
ase-extxyz
ASE I/O plugin backed by the libextxyz C parser
quippy-ase
ASE-compatible Python bindings for the QUIP and GAP codes
extxyz
Extended XYZ file format tools
marimo-precompute
Precompute and cache expensive notebook computations for static WASM deployment
mograder
Semi-automated grading for Marimo notebooks
ase-uhal
Implementation of 'Universal HyperActive Learning' compatible with the Atomic Simulation Environment (ASE)
f90wrap
Fortran to Python interface generator with derived type support
matscipy
Generic Python Materials Science tools