Alternatives and similar repositories for colmena

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

• ExaWorks / SDK
  ExaWorks SDK
  ☆11Updated last year
• argonne-lcf / balsam
  High throughput workflows and automation for HPC
  ☆82Updated 3 weeks ago
• CrossFacilityWorkflows / DOE-HPC-workflow-training
  Repo for a DOE HPC workflow training event
  ☆13Updated 2 years ago
• wavefunction91 / GauXC
  GauXC is a modern, modular C++ library for the evaluation of quantities related to the exchange-correlation (XC) energy (e.g. potential, …
  ☆35Updated last month
• ExaChem / exachem
  Open Source Exascale Computational Chemistry Software
  ☆25Updated last week
• hpc-uk / build-instructions
  Contains build scripts and instructions for software on a variety of UK HPC resources
  ☆86Updated 2 months ago
• funcx-faas / funcx-web-service
  ☆14Updated 3 years ago
• NERSC / sfapi_client
  Python client for SF API
  ☆14Updated last month
• pyiron / executorlib
  Up-scale python functions for high performance computing (HPC)
  ☆35Updated last week
• Garden-AI / garden
  ☆33Updated this week
• RMGDFT / rmgdft
  RMG is an Open Source code for electronic structure calculations and modeling of materials and molecules. It is based on density function…
  ☆48Updated 2 weeks ago
• Mantevo / miniMD
  MiniMD Molecular Dynamics Mini-App
  ☆49Updated 4 months ago
• glotzerlab / signac-flow
  Workflow management for signac-managed data spaces.
  ☆47Updated last week
• DLHub-Argonne / dlhub_sdk
  Python Interface to the Data and Learning Hub for Science
  ☆28Updated 2 years ago
• LLNL / inq
  This is a mirror. Please check our main website on gitlab.
  ☆29Updated 2 months ago
• LLNL / mgmol
  MGmol is a scalable O(N) First-Principles Molecular Dynamics code that is capable of performing large-scale electronics structure calcula…
  ☆43Updated this week
• ECP-copa / CabanaMD
  Molecular dynamics proxy application based on Cabana
  ☆21Updated 4 months ago
• votca / xtp
  GW-BSE for excited state Quantum Chemistry in a Gaussian Orbital basis, electronic spectroscopy with QM/MM, charge and energy dynamics in…
  ☆29Updated 3 years ago
• ExaWorks / psij-python
  ☆30Updated this week
• nomad-coe / greenX
  Library for Green’s function based electronic structure theory calculations
  ☆25Updated last month
• mala-project / mala
  Materials Learning Algorithms. A framework for machine learning materials properties from first-principles data.
  ☆93Updated last month
• radical-cybertools / radical.pilot
  RADICAL-Pilot
  ☆63Updated last week
• argonne-lcf / GettingStarted
  Collection of small examples for running on ALCF resources
  ☆19Updated 3 weeks ago
• materials-data-facility / connect_client
  The MDF Connect Client is the Python client to easily submit datasets to MDF Connect.
  ☆10Updated last year
• lanl / hippynn
  python library for atomistic machine learning
  ☆84Updated last week
• mstsuite / lsms
  LSMS is a code for scalable first principles calculations of materials using multiple scattering theory.
  ☆28Updated 2 months ago
• argonne-lcf / inference-endpoints
  This is a repository with examples to run inference endpoints on various ALCF clusters
  ☆23Updated 3 weeks ago
• lzhengchun / BraggNN
  Faster X-ray Bragg Peak Analysis with Deep Learning
  ☆15Updated 3 years ago
• metatensor / metatensor
  Self-describing sparse tensor data format for atomistic machine learning and beyond
  ☆77Updated last week
• psi4 / gau2grid
  Fast computation of a gaussian and its derivative on a grid.
  ☆30Updated last month