Alternatives and similar repositories for foundry:

Users that are interested in foundry are comparing it to the libraries listed below

• WardLT / applied-ai-for-materials
  Course materials for "Applied AI for Materials Science and Engineering"
  ☆59Updated 2 years ago
• TRI-AMDD / CAMD
  Agent-based sequential learning software for materials discovery
  ☆61Updated last year
• MaterialEyes / Plot2Spec
  an automatic plot digitizer for spectroscopy images (i.e. XANES and Raman)
  ☆31Updated 2 years ago
• sparks-baird / mat_discover
  A materials discovery algorithm geared towards exploring high-performance candidates in new chemical spaces.
  ☆39Updated 6 months ago
• lanl / hippynn
  python library for atomistic machine learning
  ☆73Updated 3 weeks ago
• mala-project / mala
  Materials Learning Algorithms. A framework for machine learning materials properties from first-principles data.
  ☆86Updated this week
• AI-multimodal / Lightshow
  A one-stop-shop for handling data in computational spectroscopy
  ☆16Updated last month
• molmd / mispr
  A software for automating materials science computations
  ☆30Updated 2 weeks ago
• CompRhys / aviary
  The Wren sits on its Roost in the Aviary.
  ☆51Updated 2 weeks ago
• materials-data-facility / awesome-bayesian-optimization
  ☆37Updated 10 months ago
• mir-group / flare_pp
  A many-body extension of the FLARE code.
  ☆36Updated 2 years ago
• zhantaochen / phonondos_e3nn
  Code Repository for "Direct prediction of phonon density of states with Euclidean neural network"
  ☆27Updated 2 years ago
• lab-cosmo / librascal
  A scalable and versatile library to generate representations for atomic-scale learning
  ☆80Updated last year
• pyscal / pyscal
  Python library written in C++ for calculation of local atomic structural environment
  ☆59Updated 5 months ago
• txie-93 / polymernet
  ☆22Updated 2 years ago
• zincware / ZnDraw
  Display and Edit Molecules (https://zndraw.icp.uni-stuttgart.de)
  ☆38Updated this week
• bjmorgan / kinisi
  A Python package for estimating diffusion properties from molecular dynamics simulations.
  ☆63Updated 2 weeks ago
• SergeiVKalinin / MSE_Fall2023
  The materials for the Fall ML in Materials course at the UTK MSE
  ☆85Updated last year
• CJBartel / predict-gibbs-energies
  ☆20Updated 4 years ago
• ML-Materials-Standards / ml-materials-checklist
  ☆31Updated 4 months ago
• blaiszik / ml_publication_charts
  ☆38Updated last year
• scikit-learn-contrib / scikit-matter
  A collection of scikit-learn compatible utilities that implement methods born out of the materials science and chemistry communities
  ☆80Updated last week
• ulissigroup / wherewulff
  WhereWulff: A semi-autonomous workflow for systematic catalyst surface reactivity under reaction conditions
  ☆30Updated 10 months ago
• jan-janssen / LangSim
  Application of Large Language Models (LLM) for computational materials science - visit jan-janssen.com/LangSim
  ☆55Updated 3 months ago
• by256 / rdfpy
  A Python module for fast computation of 2D and 3D radial distribution functions (RDFs).
  ☆27Updated last year
• materialsvirtuallab / nano281
  Data Science for Materials Science
  ☆60Updated 11 months ago
• lamalab-org / mofdscribe
  An ecosystem for digital reticular chemistry
  ☆44Updated 5 months ago
• openkim / kliff
  KIM-based Learning-Integrated Fitting Framework for interatomic potentials.
  ☆34Updated 2 weeks ago
• CederGroupHub / alabos
  AlabOS: Managing the workflows in the Autonomous lab
  ☆38Updated 3 months ago
• materialsproject / jobflow
  jobflow is a library for writing computational workflows.
  ☆99Updated this week