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Pull requests: lanl/hippynn
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fix imports issue causing error when building docs
#80
by shinkle-lanl
was merged Jun 24, 2024
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update docstring format in molecular_dynamics/md.py for compatibility with sphinx
#79
by shinkle-lanl
was merged Jun 24, 2024
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06102024 add optimizer/ with batch FIRE algorithm implemented with py…
#78
by amateurcat
was merged Jun 10, 2024
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Add custom MD driver and improve pairfinder memory performance
#71
by shinkle-lanl
was merged Jun 5, 2024
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remove need for backwards compatibility operation in feature nodes
#65
by lubbersnick
was merged Apr 9, 2024
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Add MultiGradient node and implement minor improvements and bug fixes for KDTree and Memory nodes
#53
by shinkle-lanl
was merged Jan 16, 2024
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Added feature for saving checkpoint every certain epochs
#51
by peterli3819
was merged Dec 20, 2023
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Add fuzzy histogram, pair-finder memory, and KD Tree pair-finder nodes; fix bugs
#50
by shinkle-lanl
was merged Dec 11, 2023
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