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39 followers · 55 following
  • Goiânia - Goiás - Brazil

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Achievement: QuickdrawAchievement: Pull Sharkx2Achievement: StarstruckAchievement: Arctic Code Vault Contributor
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jeffrichardchemistry/README.md

Hi there 👋

Jeff Stats Jeff most languages

👨  Research fields

Theoretical Chemistry | Cheminformatics | Spectroscopy | Data Science | QSAR/QSPR/QSDAR

🚀  Skills

Programming

Jeff-py Jeff-R Jeff-ShellScript Jeff-Linux Jeff-HTML Jeff-CSS Jeff-MySQL Jeff-Postgresql

🌎  Contacts:

Linkedin: Jefferson Gmail Badge GitHub Jefferson

Pinned

  1. pyECLAT pyECLAT Public

    A package for association analysis using the ECLAT method.

    Python 25 6

  2. pyADA pyADA Public

    A cheminformatics package to perform Applicability Domain of molecular fingerprints based in similarity calculation.

    Jupyter Notebook 20 8

  3. pySiRC pySiRC Public

    Simple web application for prediction of reaction rate constant through machine learning models using molecular fingerprints.

    Python 12 4

  4. SpectraFP SpectraFP Public

    A package to perform fingerprints from spectroscopy datas.

    Jupyter Notebook 7 2

  5. spyn spyn Public

    A software for ssnmr shield tensors calculations based on GIPAW method, Visualization of theoretical and experimental spectra, Conformer Generator with Genetic Algorithm and Boltzmann Probability o…

    Python 5

  6. molbokeh molbokeh Public

    A new python package to visualize molecules in dots hover

    Jupyter Notebook 4 1