Chemical-Reaction-Aware Molecule Representation Learning
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Updated
Jun 21, 2022 - Python
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molecule-representation-learning
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Official implementation for the paper "Learning Substructure Invariance for Out-of-Distribution Molecular Representations" (NeurIPS 2022).
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Feb 16, 2023 - Python
The official implementation of our paper "MoleRec: Combinatorial Drug Recommendation with Substructure-Aware Molecular Representation Learning" (TheWebConf 2023).
recommender-system
electronic-health-records
medical-records
molecule-representation-learning
medication-combination-prediction
combinatorial-drug-recommendation
medication-combination-recommendation
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Jun 8, 2023 - Python
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