Alternatives and similar repositories for skunk

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

• JacksonBurns / astartes
  Better Data Splits for Machine Learning
  ☆83Updated last month
• molstar / ipymolstar
  Mol* as anywidget
  ☆39Updated last month
• MLMI2-CSSI / foundry
  Simplifying the discovery and usage of machine-learning ready datasets in materials science and chemistry
  ☆81Updated last month
• materials-data-facility / awesome-bayesian-optimization
  ☆40Updated last year
• pythoninchemistry / intro_python_chemists
  An open-source, online textbook introducing Python programming to chemistry students
  ☆26Updated 4 years ago
• cgohlke / molmass
  Molecular mass calculations.
  ☆63Updated 3 months ago
• fekad / jupyter-jsmol
  This is JSmol viewer widget for Jupyter Notebooks and JupyterLab
  ☆33Updated 2 years ago
• georg-unterholzner / kneebow
  Knee or elbow detection for curves
  ☆21Updated 10 months ago
• andreasfuhr / sciplot
  Format Matplotlib scientific plots
  ☆18Updated 3 years ago
• NSLS-II / scientific-python-cookiecutter
  a tutorial and 'cookiecutter' template for a scientific Python library
  ☆118Updated 2 years ago
• Edinburgh-Chemistry-Teaching / Data-driven-chemistry
  ☆28Updated last year
• materialsproject / jobflow
  jobflow is a library for writing computational workflows.
  ☆104Updated last week
• leonardo-chiappisi / pyDSC
  Set of python scripts for the correction of DSC data.
  ☆23Updated 8 months ago
• mcs07 / CIRpy
  Python wrapper for the NCI Chemical Identifier Resolver (CIR)
  ☆126Updated last year
• spectrochempy / spectrochempy
  SpectroChemPy is a framework for processing, analyzing and modeling spectroscopic data for chemistry with Python
  ☆149Updated this week
• IUPAC / WFChemCookbook
  The IUPAC WorldFAIR Cookbook for FAIR chemical data
  ☆25Updated last month
• awesome-panel / panel-chemistry
  🧪📈 🐍. The purpose of the panel-chemistry project is to make it really easy for you to do DATA ANALYSIS and build powerful DATA AND VI…
  ☆119Updated last year
• molstar / molrender
  Create macromolecular images
  ☆32Updated 3 months ago
• coderefinery / documentation
  How to document your research software
  ☆31Updated 2 weeks ago
• Garden-AI / garden
  ☆33Updated this week
• mehradans92 / shadyquant
  Shaded 😎 quantile plots
  ☆12Updated 3 years ago
• deepanshs / mrsimulator
  A fast solid-state NMR spectrum simulation and analysis library.
  ☆39Updated last week
• edgarsmdn / GH-GNN
  Gibbs-Helmholtz Graph Neural Network
  ☆19Updated last year
• glotzerlab / signac
  Manage large and heterogeneous data spaces on the file system.
  ☆133Updated last week
• marda-alliance / metadata_extractors
  A Working Group on connecting and advancing interoperability of efforts on automated extraction of metadata from materials and chemical f…
  ☆14Updated last year
• sissa-data-science / DADApy
  Distance-based Analysis of DAta-manifolds in python
  ☆131Updated last week
• khoivan88 / pka_lookup
  Python script to lookup pKa values
  ☆26Updated last month
• paucablop / chemotools
  Integrate your chemometric tools with the scikit-learn API 🧪 🤖
  ☆57Updated this week
• FAU-LAP / NOMAD-CAMELS
  We are developing a configurable measurement software (CAMELS), targeted towards the requirements of experimental solid-state physics. He…
  ☆15Updated last week
• Autodesk / notebook-molecular-visualization
  2D and 3D molecular visualization in Jupyter notebooks using 3DMol.js and D3.js
  ☆81Updated 7 years ago