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The browser-based OpenMM script writer is dead... long live the browser-based OpenMM script writer!

http://builder.openmm.org has been a dead link for a while. The still-in-development version of that tool is OpenMM-Setup, which is intended to run locally (presumably because it also supports a bunch of PDBFixer and related stuff to set up a simulation, which is too computationally expensive to run on openmm.org.)

This corrects notebook 1 to point to the right place to learn more about OpenMM. This is one of the issues listed in #15.

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This is ready for review and comment. I will leave it open for at least 24 hours, merging no earlier than Thu 11 Nov 21:00 GMT (16:00 my local).

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LGTM

@dwhswenson dwhswenson merged commit b2b42da into openpathsampling:main Nov 11, 2021
@dwhswenson dwhswenson deleted the openmm-setup branch November 11, 2021 23:33
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2 participants