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ZENODO
Software . 2018
Data sources: Datacite
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ZENODO
Software . 2018
Data sources: ZENODO
Claim

choderalab/yank: 0.23.1 - Multi-Experiment and Online Bug

integration_instructionsResearch softwarekeyboard_double_arrow_right Software 12 Jul 2018Publisher:Zenodo
Authors: Andrea Rizzi; John Chodera; Levi Naden; Kyle Beauchamp; Patrick Grinaway; Bas Rustenburg; Steven Albanese; +1 Authors
Code repository: https://github.com/choderalab/yank/tree/0.23.1

doi: 10.5281/zenodo.1311217

choderalab/yank: 0.23.1 - Multi-Experiment and Online Bug

Abstract

Fixed bug in MultiExperimentAnalyzer where a path ending in the folder separator (e.g. /) caused all files to write to the same place. Fixed bug where increasing number of iterations did not continue experiment if online analysis was turned on and previously hit the max number of iterations Fixed bug where online analysis and harmonic unbiasing caused MBAR to not form due to misformed initial_f_k MultiExperimentAnalyzer now gracefully traps an error caught by one experiment without crashing others Fixed bug in MultiStateReporter when there were unsampled thermodynamic states as end-states but they referenced sampled thermodynamic states for their standard system

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popularity
This indicator reflects the "current" impact/attention (the "hype") of an article in the research community at large, based on the underlying citation network.
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This indicator reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
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