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  1. Advanced toolkit for binding free energy calculations

    Python 2 3

  2. Forked from manubot/manubot

    The manuscript bot for automated scholarly publishing


  3. Nonequilibrium kinetic modeling of amino acid rotary motors

    Jupyter Notebook

  4. Forked from openforcefield/openforcefield

    Open Forcefield Group tools

    Jupyter Notebook

  5. Host-guest binding calculations with the SMIRNOFF99Frosst force field

    Jupyter Notebook

535 contributions in the last year

Mar Apr May Jun Jul Aug Sep Oct Nov Dec Jan Feb Mar Mon Wed Fri

Contribution activity

March 2019

Created a pull request in slochower/pAPRika that received 2 comments

Update formatting with isort, autoflake, and black

isort -rc . autoflake -r --in-place --remove-unused-variables . black .

+331 −172 2 comments

Created an issue in manubot/rootstock that received 17 comments

Possibly incorrect rendering of unicode superscripts in

Unicode superscripts look incorrect (specifically digits 1,2,3,4) on Firefox 65.0.2 and macOS 10.14.3. Subscripts look okay. Know what's up @vincer…


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