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LVPP

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  1. sigma sigma Public

    LVPP sigma-profile database + COSMO-SAC parametrizations

    Python 58 29

  2. pysac pysac Public

    Pairwise interaction segment activity coefficients, reference implementation in Python

    Jupyter Notebook 12 1

  3. f-sac f-sac Public

    Functional-Segment Activity Coefficient model

    Fortran 4 4

  4. TriangularPlot TriangularPlot Public

    A jfreechart extension for triangular plots (ternary diagrams).

    Java

  5. nwchem nwchem Public

    Forked from nwchemgit/nwchem

    NWChem: Open Source High-Performance Computational Chemistry

    Fortran

  6. molecular-modelling molecular-modelling Public

    Forked from shoubhikraj/molecular-modelling

    PowerShell

Repositories

Showing 6 of 6 repositories
  • sigma Public

    LVPP sigma-profile database + COSMO-SAC parametrizations

    lvpp/sigma’s past year of commit activity
    Python 58 MIT 29 6 0 Updated Nov 2, 2024
  • pysac Public

    Pairwise interaction segment activity coefficients, reference implementation in Python

    lvpp/pysac’s past year of commit activity
    Jupyter Notebook 12 MIT 1 0 0 Updated Apr 27, 2024
  • molecular-modelling Public Forked from shoubhikraj/molecular-modelling
    lvpp/molecular-modelling’s past year of commit activity
    PowerShell 0 MIT 2 0 0 Updated May 8, 2022
  • nwchem Public Forked from nwchemgit/nwchem

    NWChem: Open Source High-Performance Computational Chemistry

    lvpp/nwchem’s past year of commit activity
    Fortran 0 164 0 0 Updated Aug 6, 2021
  • TriangularPlot Public

    A jfreechart extension for triangular plots (ternary diagrams).

    lvpp/TriangularPlot’s past year of commit activity
    Java 0 0 0 0 Updated Aug 26, 2020
  • f-sac Public

    Functional-Segment Activity Coefficient model

    lvpp/f-sac’s past year of commit activity
    Fortran 4 4 1 1 Updated Nov 8, 2019

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