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@MolarVerse

MolarVerse

Molecular Metaverse for In-Silico Chemistry and Material Science Solutions

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  1. PQ PQ Public

    C++ 10 4

  2. PQAnalysis PQAnalysis Public

    PQAnalysis is a API/CLI python package for the analysis of MD simulations

    Python 7 1

  3. PQEnalyzer PQEnalyzer Public

    Analyzation of Molecular Dynamic Trajectories - PQ

    Python 4 1

  4. ThermoScreening ThermoScreening Public

    Thermochemistry and molecular screening workflows for DFTB+, xTB, and quantum-chemistry outputs.

    Python 3

  5. VibrationalAnalysis.jl VibrationalAnalysis.jl Public

    Vibrational analysis on PQ output.

    Julia 2

  6. PQViewer PQViewer Public

    Molecular structure and trajectory viewer built on PQAnalysis.

    TypeScript 2

Repositories

Showing 10 of 11 repositories
  • PQ Public
    MolarVerse/PQ's past year of commit activity
    C++ 10 GPL-3.0 4 86 3 Updated Oct 8, 2026
  • PQAnalysis Public

    PQAnalysis is a API/CLI python package for the analysis of MD simulations

    MolarVerse/PQAnalysis's past year of commit activity
    Python 7 MIT 1 4 0 Updated Oct 6, 2026
  • PQViewer Public

    Molecular structure and trajectory viewer built on PQAnalysis.

    MolarVerse/PQViewer's past year of commit activity
    TypeScript 2 MIT 0 1 0 Updated Oct 6, 2026
  • PQSetup Public

    Prepare and validate PQ simulation inputs.

    MolarVerse/PQSetup's past year of commit activity
    Python 0 MIT 0 0 0 Updated Oct 6, 2026
  • PQEnalyzer Public

    Analyzation of Molecular Dynamic Trajectories - PQ

    MolarVerse/PQEnalyzer's past year of commit activity
    Python 4 MIT 1 5 0 Updated Oct 6, 2026
  • PQDesign Public

    Shared flat mono design tokens and React controls for MolarVerse PQ tools

    MolarVerse/PQDesign's past year of commit activity
    TypeScript 0 MIT 0 0 0 Updated Oct 6, 2026
  • staged-recipes Public Forked from conda-forge/staged-recipes

    A place to submit conda recipes before they become fully fledged conda-forge feedstocks

    MolarVerse/staged-recipes's past year of commit activity
    Python 0 BSD-3-Clause 6,412 0 0 Updated Sep 15, 2026
  • Numerov.jl Public

    Grid-based Schrödinger equation solver: 1D/2D/3D potentials, high-order finite-difference stencils, periodic systems and band structures

    MolarVerse/Numerov.jl's past year of commit activity
    Julia 1 MIT 0 0 0 Updated Aug 11, 2026
  • MolarVerse/molarverse.github.io's past year of commit activity
    Sass 0 0 0 0 Updated Jul 29, 2026
  • ThermoScreening Public

    Thermochemistry and molecular screening workflows for DFTB+, xTB, and quantum-chemistry outputs.

    MolarVerse/ThermoScreening's past year of commit activity
    Python 3 LGPL-2.1 0 1 0 Updated Jul 24, 2026