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add atom type diffusion
* chore: delete duplicate code * chore: change save frequency
* feat: change diffusion code for mattergen * fix: scale shared grads only works on gemnet
* chore: change save path in config * chore: annotate useless code * update config * add guiduce for mattergen
* chore: annotate useless code * [feat]: add reconstruct metrics
add diffcsp++ with types and fixe the sample function of diffcsp++
docs: tidy mattergen diffcsp infgcn readmes
Docs/metax benchmark
* update infgcn pipeline and deps * fix bugs for last commit * fix error * fix error * fix error * fix chgnet bug & fix infgcn config shuffle error * fix readme --------- Co-authored-by: ppmat-bot <ppmat-bot@example.com>
add weights of diffnmr
* Delete electronic_structure/configs/infgcn/infgcn_omol25_trimmed.yaml * Update README.md * Update infgcn_omol25_MC_5k_trimmed.yaml * Delete electronic_structure/configs/infgcn/infgcn_omol25.yaml
* Revise copyright and authorship statements Updated copyright information and authorship details. * Revise copyright and ownership details in mattergen.py Updated copyright notice and ownership information. * Update property_embeddings.py * Update copyright and ownership information in globals.py
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mace-paddle-2
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