Repositories list

• docs

  Public
  Documentation hosting for metatensor

  HTML

  •0•0•0•0•Updated Nov 14, 2024Nov 14, 2024

• metatensor

  Public
  Self-describing sparse tensor data format for atomistic machine learning and beyond

  Python

  •

  BSD 3-Clause "New" or "Revised" License

  •19•53•67•5•Updated Nov 14, 2024Nov 14, 2024

• metatrain

  Public
  Training and evaluating machine learning models for atomistic systems.

  Python

  •

  BSD 3-Clause "New" or "Revised" License

  •5•18•30•5•Updated Nov 14, 2024Nov 14, 2024

• lammps

  Public
  Metatensor-enabled version of LAMMPS

  C++

  •

  GNU General Public License v2.0

  •1.7k•0•1•2•Updated Oct 30, 2024Oct 30, 2024

• lj-test

  Public
  Shifted Lennard-Jones as a metatensor atomistic model, used to test the API integration

  Python

  •

  MIT No Attribution

  •0•0•0•0•Updated Oct 28, 2024Oct 28, 2024

• plumed-conda

  Public
  Conda recipe to build plumed & co

  Shell

  •10•0•0•0•Updated Oct 22, 2024Oct 22, 2024

• gromacs

  Public
  Metatensor-enabled GROMACS

  C++

  •

  GNU Lesser General Public License v2.1

  •331•0•0•0•Updated Oct 4, 2024Oct 4, 2024

• metatensor-feedstock

  Public
  A conda-smithy repository for metatensor.

  Batchfile

  •

  BSD 3-Clause "New" or "Revised" License

  •2•0•0•0•Updated Aug 29, 2024Aug 29, 2024

• plumed-metatensor-tests

  Public
  Regression tests for the plumed <=> metatensor interface

  Shell

  •0•0•0•0•Updated Jul 2, 2024Jul 2, 2024

• libmetatensor-torch-feedstock

  Public
  A conda-smithy repository for libmetatensor-torch.

  CMake

  •

  BSD 3-Clause "New" or "Revised" License

  •2•0•0•0•Updated May 21, 2024May 21, 2024

• libmetatensor-feedstock

  Public
  A conda-smithy repository for libmetatensor.

  Batchfile

  •

  BSD 3-Clause "New" or "Revised" License

  •2•0•0•0•Updated May 15, 2024May 15, 2024