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it's never A to B ~ John Tavner
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it's never A to B ~ John Tavner

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@openforcefield

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  1. sage-2.2.0 Public

    Minor version of Sage line of force fields

    Jupyter Notebook 1

  2. openforcefield/sage-2.1.0 Public

    Minor version of Sage line of force fields

    Jupyter Notebook

  3. openforcefield/qca-dataset-submission Public

    Data generation and submission scripts for the QCArchive ecosystem.

    Jupyter Notebook 35 6

  4. dupuislab/CP2K Public

    Forked from pavankum/cp2k-vab

    Feature additions to CP2K-6.1

    Fortran

  5. double-exp-vdw Public

    Forked from jthorton/double-exp-vdw

    Experimental fits of a double expoential force field.

    Python

  6. MobleyLab/qm-theory-benchmark Public

    Jupyter Notebook 4 1

39 contributions in the last year

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Activity overview

Contributed to pavankum/colab-fold-files, pavankum/SFE_Calcs, pavankum/boltz1_trial and 5 other repositories
Loading A graph representing pavankum's contributions from June 09, 2024 to June 12, 2025. The contributions are 91% commits, 6% issues, 3% code review, 0% pull requests.

Contribution activity

June 2025

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