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  • Red Hat

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Achievement: Pair ExtraordinaireAchievement: QuickdrawAchievement: Pull Sharkx3Achievement: Arctic Code Vault Contributor

Achievements

Achievement: Pair ExtraordinaireAchievement: QuickdrawAchievement: Pull Sharkx3Achievement: Arctic Code Vault Contributor

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@AdaptivePELE

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Pinned

  1. BSC-CNS-EAPM/AdaptivePELE BSC-CNS-EAPM/AdaptivePELE Public

    AdaptivePELE is a Python package aimed at enhancing the sampling of molecular simulations

    Python 14 13

  2. cibyl cibyl Public

    Forked from RedHatCRE/cibyl

    Python

  3. znoyder znoyder Public

    Forked from RedHatCRE/znoyder

    Automate preparation of downstream CI jobs for Red Hat OpenStack Platform (OSP) releases.

    Python

  4. drug_learning drug_learning Public

    Forked from danielSoler93/drug_learning

    Open package with DL and ML tools for drug discovery. It is based in a 3 branch package: 2D-QSAR, 3D-QSAR, simulation+AI

  5. mdtraj mdtraj Public

    Forked from mdtraj/mdtraj

    A modern, open library for the analysis of molecular dynamics trajectories

    C

  6. PyEMMA PyEMMA Public

    Forked from markovmodel/PyEMMA

    🚂 Python API for Emma's Markov Model Algorithms 🚂

    Python