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@Mishima-syk Mishima.syk

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    22 repositories

    • REINVENT4

      Public
      AI molecular design tool for de novo design, scaffold hopping, R-group replacement, linker design and molecule optimization.
      Python
      •
      Apache License 2.0
      •92•2•0•0•Updated Oct 14, 2024Oct 14, 2024

    • Mishima-syk.github.io

      Public
      Mishima-syk site repo
      SCSS
      •
      MIT License
      •0•2•0•0•Updated Oct 11, 2024Oct 11, 2024

    • maize

      Public
      A graph-based workflow manager for computational chemistry pipelines
      Python
      •
      Apache License 2.0
      •3•0•0•0•Updated Oct 11, 2024Oct 11, 2024

    • 21

      Public
      0•0•0•0•Updated Sep 29, 2024Sep 29, 2024

    • maize-contrib

      Public
      Contributed and additional nodes for maize
      Python
      •
      Apache License 2.0
      •5•0•0•0•Updated Aug 19, 2024Aug 19, 2024

    • 19

      Public
      Jupyter Notebook
      •0•0•0•0•Updated Feb 22, 2023Feb 22, 2023

    • psikit

      Public
      psi4+RDKit
      chemistrycheminformaticsquantum-chemistrychemoinformaticspsirdkit
      Python
      •
      BSD 3-Clause "New" or "Revised" License
      •20•97•15•0•Updated Dec 10, 2022Dec 10, 2022

    • 18

      Public
      Python
      •1•1•0•0•Updated Apr 18, 2022Apr 18, 2022

    • py4chemoinformatics

      Public
      Python for chemoinformatics
      cheminformaticsscikit-learnchemoinformaticspythonjupyterrdkit
      Jupyter Notebook
      •
      Other
      •91•222•2•0•Updated Jun 26, 2021Jun 26, 2021

    • 16

      Public
      16th meeting
      Jupyter Notebook
      •1•3•0•0•Updated Dec 2, 2020Dec 2, 2020

    • kinme

      Public
      knime workflow sharing server
      Python
      •
      BSD 3-Clause "New" or "Revised" License
      •0•5•1•0•Updated Oct 24, 2019Oct 24, 2019

    • markdown2pptx

      Public
      PowerPoint presentation generator from markdown style text file.
      Python
      •0•3•0•0•Updated Oct 12, 2019Oct 12, 2019

    • 14

      Public
      14th meeting
      0•0•0•0•Updated Sep 22, 2019Sep 22, 2019

    • SOSOG

      Public
      reference management and comment sharing system
      JavaScript
      •
      MIT License
      •0•0•0•0•Updated Apr 29, 2019Apr 29, 2019

    • sklearn-tutorial

      Public
      Jupyter Notebook
      •4•8•2•0•Updated Mar 12, 2019Mar 12, 2019

    • 13

      Public
      13th Mishima.syk meeting
      Jupyter Notebook
      •1•3•0•0•Updated Feb 9, 2019Feb 9, 2019

    • 12

      Public
      mishima.syk #12
      pythonbioinformaticschemoinformatics
      Jupyter Notebook
      •1•2•0•0•Updated Jun 24, 2018Jun 24, 2018

    • 11

      Public
      11th meeting
      Jupyter Notebook
      •12•3•0•0•Updated Oct 15, 2017Oct 15, 2017

    • 10

      Public
      mishima.syk #10
      Python
      •0•1•0•0•Updated Jul 9, 2017Jul 9, 2017

    • sarviz_web

      Public
      CSS
      •0•0•0•0•Updated Jul 4, 2017Jul 4, 2017

    • 9

      Public
      mishima.syk #9
      Jupyter Notebook
      •2•2•0•0•Updated Dec 13, 2016Dec 13, 2016

    • 8

      Public
      8th meeting on 160528 at Numazu
      0•0•0•0•Updated May 29, 2016May 29, 2016