Alternatives and similar repositories for plato

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

• materialsproject / maggma
  Building blocks for scientific data pipelines
  ☆40Updated last week
• materialsproject / jobflow
  jobflow is a library for writing computational workflows.
  ☆104Updated 2 weeks ago
• orionarcher / pymatgen-io-openmm
  A Pymatgen IO module for setting up OpenMM simulations.
  ☆11Updated last year
• materialsproject / pymatgen-io-validation
  Comprehensive input/output validator. Made with the purpose of ensuring VASP calculations are compatible with Materials Project data, wit…
  ☆13Updated 2 weeks ago
• FrederikLizakJohansen / DebyeCalculator
  A vectorised implementation of the Debye Scattering Equation on CPU and GPU
  ☆31Updated 7 months ago
• aiidalab / aiidalab
  Implements core functions for AiiDAlab.
  ☆16Updated 2 weeks ago
• JaGeo / Advanced_Jobflow_Tutorial
  This is a repository containing an advanced tutorial for jobflow (https://github.com/materialsproject/jobflow) related to computational …
  ☆17Updated 2 years ago
• mturiansky / abcv
  A python-based crystal viewer built upon the fresnel and pymatgen libraries.
  ☆16Updated last year
• zincware / ZnDraw
  Display and Edit Molecules (https://zndraw.icp.uni-stuttgart.de)
  ☆44Updated this week
• openkim / kimpy
  Python interface to the KIM API. See https://openkim.org/kim-api for more information about the KIM API.
  ☆16Updated 3 months ago
• cersonsky-lab / AniSOAP
  Library for computing anisotropy extension to SOAP descriptors
  ☆12Updated last week
• chrisjsewell / ase-notebook
  Highly configurable 2D (SVG) & 3D (threejs) visualisations for ASE/Pymatgen structures, within the Jupyter Notebook.
  ☆34Updated 2 years ago
• Griffin-Group / pymatgen-io-espresso
  A pymatgen addon for parsing Quantum ESPRESSO files
  ☆23Updated 7 months ago
• BlauGroup / HiPRGen
  ☆25Updated 8 months ago
• lan496 / crystal-symmetry-primer
  Primer of crystal symmetry and space group
  ☆16Updated 2 years ago
• Luthaf / vesin
  Compute neighbor lists for atomistic systems
  ☆54Updated this week
• lrcfmd / ICSDClient
  A python library for accessing the ICSD API Client. Under no affiliation with Fitz-Karlsruhe, please see https://icsd.fiz-karlsruhe.de/in…
  ☆19Updated 8 months ago
• cersonsky-lab / unsupervised-ml
  This git repository will serve as a companion to a forthcoming chapter in "Quantum Chemistry in the Age of Machine Learning"
  ☆15Updated 11 months ago
• spglib / moyo
  Library for Crystal Symmetry in Rust
  ☆52Updated this week
• microsoft / aiida-dynamic-workflows
  An AiiDA plugin for dynamically defining workflows using Python functions
  ☆17Updated 3 years ago
• pprcht / gfnff
  A standalone library of the GFN-FF method. Extracted in large parts from the xtb program.
  ☆14Updated 5 months ago
• ftherrien / p2ptrans
  An algorithm to match crystal structures atom-to-atom
  ☆52Updated 2 years ago
• AI-multimodal / Lightshow
  A one-stop-shop for handling data in computational spectroscopy
  ☆16Updated 4 months ago
• dwiddo / average-minimum-distance
  Descriptors (isometry invariants) of crystals based on geometry.
  ☆27Updated 3 weeks ago
• ur-whitelab / hoomd-tf
  A plugin that allows the use of Tensorflow in Hoomd-Blue for GPU-accelerated ML+MD
  ☆32Updated 11 months ago
• SCM-NV / qmflows
  This library tackles the construction and efficient execution of computational chemistry workflows
  ☆48Updated last year
• muhrin / milad
  Moment Invariants Local Atomic Descriptor
  ☆32Updated 11 months ago
• materialsproject / pyrho
  ☆40Updated last week
• lab-cosmo / librascal
  A scalable and versatile library to generate representations for atomic-scale learning
  ☆81Updated last year
• lmmentel / ase-espresso
  ase interface for Quantum Espresso
  ☆22Updated 4 years ago