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@BioKT

BIOKT Group

BioKimika Teorikoa Group @ EHU + DIPC

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  1. MasterMSM MasterMSM Public

    Python package for generating Markov state models

    Python 17 7

  2. AdaptiveMasterMSM AdaptiveMasterMSM Public

    Adaptive sampling implementation interacting with MasterMSM

    Python 3 2

  3. MartiniSurf MartiniSurf Public

    MartiniSurf: a package for the preparation of Martini simulations of immobilized proteins

    Python 2

  4. PLUMED-docs PLUMED-docs Public

    Working examples of different types of molecular dynamics simulations that can be run using Gromacs patched with PLUMED

    Jupyter Notebook 1

  5. claude-biokt-slides claude-biokt-slides Public

    Claude Code seminar slides for biomolecular simulation and computational chemistry

    TeX 1

  6. ResDocs ResDocs Public

    HTML

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