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Pull requests: deepmodeling/DeePTB
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feat: add tensorboard support
Feature Request
New feature or request
#206
by Franklalalala
was merged Aug 27, 2024
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refactor(data preprocess): remove the cut off options from info.json
#200
by QG-phy
was merged Aug 13, 2024
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build(deps): bump docker/build-push-action from 5 to 6
dependencies
Pull requests that update a dependency file
#196
by dependabot
bot
was merged Jul 2, 2024
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Update: support read multiple lmdb data file with LMDBDataset
#194
by floatingCatty
was merged Jun 18, 2024
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Update: support f/g/h orbital in sk hamiltonian
#192
by floatingCatty
was merged Jun 15, 2024
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Fix: fix frame index to compatible with 0 starts
#190
by floatingCatty
was merged Jun 13, 2024
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Update(default_dataset.py): compatible with dftio's dat format
#189
by floatingCatty
was closed Jun 12, 2024
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Fix(tensor_product.py): fix the error when set radial embedding == False
#188
by floatingCatty
was merged Jun 12, 2024
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Update: Organize e3, add e3 statistics in LMDB dataset and add e3 fitting of overlap
#183
by floatingCatty
was merged Jun 6, 2024
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