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Pull requests: choderalab/pymbar
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Fix to bootstrap of free energy surfaces, affecting timing and quantitative results
#535
opened Aug 26, 2024 by
mrshirts
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Make using JAX (or any accelerator) an Instanced Python class (and toggle)
#509
opened Jun 22, 2023 by
Lnaden
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[WIP] jitted just the inner loop of the adaptive loop
pymbar 4
#402
opened Jun 30, 2020 by
mrshirts
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Configure logging with support for verbose flags
pymbar 4
#391
opened Apr 27, 2020 by
jaimergp
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