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Pull requests list

minor changes to MD code & its documentation
#81 by shinkle-lanl was merged Jun 24, 2024 Loading…
fix imports issue causing error when building docs
#80 by shinkle-lanl was merged Jun 24, 2024 Loading…
add documentation for new md code
#77 by shinkle-lanl was merged Jun 6, 2024 Loading…
add documentation for new md code
#76 by shinkle-lanl was merged Jun 6, 2024 Loading…
update documentation
#75 by shinkle-lanl was closed Jun 6, 2024 Loading…
fix coordinate wrapping issue
#73 by shinkle-lanl was merged Jun 4, 2024 Loading…
Added write_h5 function
#70 by bnebgen-LANL was merged Apr 30, 2024 Loading…
Ensemble creation feature
#68 by lubbersnick was merged Apr 13, 2024 Loading…
energy initialization
#66 by shinkle-lanl was merged Apr 10, 2024 Loading…
Deploy versioneer 0.29
#64 by lubbersnick was merged Apr 10, 2024 Loading…
add weights for loss functions
#63 by lubbersnick was merged Apr 8, 2024 Loading…
add features and example for using them
#62 by lubbersnick was merged Apr 5, 2024 Loading…
Updated Cusp Regularization
#59 by sakibmatin was merged Apr 9, 2024 Loading…
Add timeplot scaling setting
#58 by shinkle-lanl was merged Jan 30, 2024 Loading…
Update version in docs
#57 by shinkle-lanl was merged Jan 22, 2024 Loading…
For updating to python 3.9
#56 by lubbersnick was merged Jan 23, 2024 Loading…
Fix vecmag class from earlier modification
#52 by bnebgen-LANL was merged Jan 8, 2024 Loading…
Allow ASE dbs with not all same entries.
#49 by mgt16-LANL was merged Dec 11, 2023 Loading…
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