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Achievement: StarstruckAchievement: Pair Extraordinairex3Achievement: Pull Sharkx3Achievement: QuickdrawAchievement: Arctic Code Vault Contributor

Achievements

Achievement: StarstruckAchievement: Pair Extraordinairex3Achievement: Pull Sharkx3Achievement: QuickdrawAchievement: Arctic Code Vault Contributor

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@openmm

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Yoshanuikabundi/README.md

Hi there 👋

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  1. openforcefield/openff-toolkit Public

    The Open Forcefield Toolkit provides implementations of the SMIRNOFF format, parameterization engine, and other tools. Documentation available at http://open-forcefield-toolkit.readthedocs.io

    Python 335 96

  2. snakes_on_a_plane Public

    Conda meets Cargo. Keep your conda dev environments local, specific, and up-to-date.

    Python 1

  3. openforcefield/openff-bespokefit Public

    Automated tools for the generation of bespoke SMIRNOFF format parameters for individual molecules.

    Python 66 10

  4. openforcefield/openff-docs Public

    Documentation for the Open Force Field ecosystem

    Jupyter Notebook 2

660 contributions in the last year

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Contribution activity

March 2025

Created 30 commits in 4 repositories
Created 3 repositories

Created a pull request in openforcefield/openff-docs that received 11 comments

Link to new RTD dashboard in examples preproc message

+12 −10 lines changed • 11 comments
Opened 7 other pull requests in 5 repositories
Reviewed 8 pull requests in 4 repositories

Created an issue in trevorgokey/besmarts that received 3 comments

Multiple errors when trying to run ff_optimize()

Hi Trevor, I've written the ff_optimize run I was trying to do last week up as a script. I've spent a fair whack of time trying to figure out what'…

3 comments
Opened 3 other issues in 1 repository
openforcefield/openff-pablo 3 open
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