You signed in with another tab or window. Reload to refresh your session.You signed out in another tab or window. Reload to refresh your session.You switched accounts on another tab or window. Reload to refresh your session.Dismiss alert
*[AtomIO](https://github.com/mfherbst/AtomIO.jl): I/O for atomic structures, also wraps some ASE functionality
42
42
*[Atomistic](https://github.com/cesmix-mit/Atomistic.jl/tree/263ec97b5f380f1b2ba593bf8feaf36e7f7cff9a): integrated workflow for MD simulations, part of [CESMIX](https://computing.mit.edu/cesmix/)
*[ChemistryFeaturization](https://github.com/Chemellia/ChemistryFeaturization.jl): Interface for featurization of atomic structures for input into machine learning models, part of [Chemellia](https://chemellia.org)
45
46
*[DFTK](https://github.com/JuliaMolSim/DFTK.jl): density functional theory simulations
0 commit comments