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Models
:
Amanda-D
/
selfies
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[1aa732]
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Initial commit
Authored by:
Amanda-D
2025-04-19
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[8997bc]
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original_code_from_paper/vae/VAE_dependencies/GPlus2S.py
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original_code_from_paper/vae/VAE_dependencies/GrammarVAE_codes.py
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original_code_from_paper/vae/VAE_dependencies/GrammarVAE_grammar.py
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original_code_from_paper/vae/VAE_dependencies/README.md
added
original_code_from_paper/vae/VAE_dependencies/data_loader.py
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original_code_from_paper/vae/settings.yml
added
original_code_from_paper/vae/settingsDeepSMILES.yml
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original_code_from_paper/vae/settingsGrammarVAE.yml
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original_code_from_paper/vae/settingsSELFIES.yml
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original_code_from_paper/vae/settingsSMILES.yml
added
original_code_from_paper/vae/vae_rnn.py
added
selfies/__init__.py
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selfies/bond_constraints.py
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selfies/compatibility.py
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selfies/constants.py
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selfies/decoder.py
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selfies/encoder.py
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selfies/exceptions.py
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selfies/grammar_rules.py
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selfies/mol_graph.py
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selfies/utils/__init__.py
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selfies/utils/encoding_utils.py
added
selfies/utils/matching_utils.py
added
selfies/utils/selfies_utils.py
added
selfies/utils/smiles_utils.py
original_code_from_paper/vae/VAE_dependencies/GPlus2S.py
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original_code_from_paper/vae/VAE_dependencies/GrammarVAE_codes.py
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original_code_from_paper/vae/VAE_dependencies/GrammarVAE_grammar.py
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original_code_from_paper/vae/VAE_dependencies/README.md
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original_code_from_paper/vae/VAE_dependencies/data_loader.py
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original_code_from_paper/vae/settings.yml
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original_code_from_paper/vae/settingsDeepSMILES.yml
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original_code_from_paper/vae/settingsGrammarVAE.yml
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original_code_from_paper/vae/settingsSELFIES.yml
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original_code_from_paper/vae/settingsSMILES.yml
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original_code_from_paper/vae/vae_rnn.py
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selfies/__init__.py
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selfies/bond_constraints.py
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selfies/compatibility.py
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selfies/constants.py
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selfies/decoder.py
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selfies/encoder.py
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selfies/exceptions.py
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selfies/grammar_rules.py
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selfies/mol_graph.py
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selfies/utils/__init__.py
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selfies/utils/encoding_utils.py
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selfies/utils/matching_utils.py
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selfies/utils/selfies_utils.py
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selfies/utils/smiles_utils.py
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