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fix(ldm): keep the VAE named by autoencoder_ckpt
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#136:
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fix: sp reg.
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#135:
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fix(loading): multiprocessing
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fix(data): automatically drop NaN rows
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#133:
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fix(ldm): add the radius_graph_utils module,
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#132:
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fix(ldm): transl. eq.
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#131:
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fix(tabasco): compare loss against centered target coords
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fix(utils): guardrail for mad norm method
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#129:
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docs: link the bundled tutorials and the test suite from the README
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docs: add contributor guidelines
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chore: CONTRIBUTING and the issue templates
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#126:
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fix; charge aug
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#125:
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fix: repair TABASCO size sampling, step override and set metrics
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#124:
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feat(diffusion): add TABASCO-style N-fold rotation augmentation
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#123:
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fix(diffusion_transformer): switch backbone to AdaLN-zero DiT blocks
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#122:
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fix build fail
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#121:
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fix build fail
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#120:
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feat: add property conditioning to TABASCO, FlowMol and MiDi and add…
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#119:
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feat(tabasco): add EGNN, GVP and Equiformer backbone variants
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#118:
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feat(equiformer): wire EquiformerV2 as a diffusion backbone
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#117:
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docs: correct checkpoint availability across the zoo
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#116:
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fix(difflinker): replace broken ZINC/GEOM checkpoints with real weights
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#115:
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feat(difflinker): add pretrained checkpoints, Size GNN, pocket suppor
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#114:
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Merge origin/main (docs: web UI link) into main
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#113:
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docs: link AutomaticMolCraft web UI in README and docs index
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#112:
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