Alternatives and similar repositories for crnpy

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

• automatedchemistry / flowchem
  Flowchem is an application to simplify the control of instruments and devices commonly found in chemistry labs.
  ☆19Updated 2 weeks ago
• rnelsonchem / pHcalc
  Systematic pH calculation package for Python
  ☆37Updated 2 years ago
• ReactionMechanismGenerator / RMG-database
  The database of chemical parameters used with Reaction Mechanism Generator
  ☆119Updated this week
• molmod / tamkin
  TAMkin is a post-processing toolkit for thermochemistry and kinetics analysis.
  ☆23Updated 2 years ago
• IvanChernyshov / NistChemPy
  Python API for NIST Chemistry WebBook
  ☆46Updated 5 months ago
• KingsburyLab / pyEQL
  A Python library for solution chemistry
  ☆71Updated last week
• fekad / jupyter-jsmol
  This is JSmol viewer widget for Jupyter Notebooks and JupyterLab
  ☆33Updated 2 years ago
• mcs07 / ChemSpiPy
  Python wrapper for the ChemSpider API
  ☆120Updated 7 years ago
• MechWolf / MechWolf
  ⚙️🐺 Robotic chemistry made easy
  ☆32Updated 2 years ago
• edgarsmdn / GH-GNN
  Gibbs-Helmholtz Graph Neural Network
  ☆19Updated 2 years ago
• polysimtools / pysimm
  python simulation interface for molecular modeling
  ☆101Updated 3 years ago
• chemreac / chemreac
  Library for chemical kinetics in homogeneous or isotropically symmetric inhomogenous systems.
  ☆15Updated 2 years ago
• pythoninchemistry / intro_python_chemists
  An open-source, online textbook introducing Python programming to chemistry students
  ☆27Updated 5 years ago
• ReactionMechanismGenerator / ARC
  ARC - Automatic Rate Calculator
  ☆47Updated this week
• PySCeS / pysces
  The official PySCeS project source code repository.
  ☆39Updated last week
• nglviewer / mdsrv
  MD trajectory server
  ☆35Updated 2 years ago
• timvdm / Avogadro-Packmol-Extension
  An Avogadro plugin with a gui to create packmol input files and run packmol from within Avogadro.
  ☆11Updated 15 years ago
• CoolProp / PC-SAFT
  Open-source implementation of PC-SAFT equation of state
  ☆12Updated 3 years ago
• HECBioSim / Longbow
  Longbow is a tool for automating simulations on a remote HPC machine. Longbow is designed to mimic the normal way an application is run l…
  ☆18Updated 2 weeks ago
• ekwan / PyQuiver
  kinetic isotope effect prediction with Gaussian
  ☆17Updated 2 years ago
• uglymol / uglymol
  Macromolecular viewer for crystallographers (WebGL)
  ☆39Updated 4 months ago
• choderalab / thermopyl
  Tools for ThermoML parsing
  ☆21Updated 4 years ago
• scotthartley / blmol
  A script for importing molecular geometries into Blender
  ☆35Updated 3 years ago
• khoivan88 / pka_lookup
  Python script to lookup pKa values
  ☆26Updated 3 months ago
• gabrielelanaro / chemview
  The new generation molecular viewer for IPython notebook
  ☆82Updated 5 years ago
• gustavochm / sgtpy
  ☆44Updated 2 weeks ago
• curieshicy / JRgui
  Python GUI program for a quick estimation of physicochemical properties of molecules.
  ☆44Updated 7 years ago
• ekwan / cctk
  Python-based library for working with computational chemistry files
  ☆21Updated last month
• OpenChemistry / mongochemserver
  Server code for MongoChem chemical data
  ☆16Updated 3 years ago
• hackingmaterials / rocketsled
  plug-n-play black box optimizer for high-throughput computing
  ☆51Updated 2 years ago