conftrace_

molecular relational learning

6 papers

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Also known as

MRL

Co-occurring keywords · papers mentioning both

graph neural network (4) information bottleneck (3) large language model (2) 3d conformation (1) self-adaptive ordering (1) molecular stereochemistry (1) chain of thought (1) interaction prediction (1) subgraph extraction (1) protein sequence encoder (1)

Papers

DO-CoLM: Dynamic 3D Conformation Relationships Capture with Self-Adaptive Ordering Molecular Relational Modeling in Language Models IJCAI 2025 Iterative Substructure Extraction for Molecular Relational Learning with Interactive Graph Information Bottleneck ICLR 2025 Subgraph Information Bottleneck with Causal Dependency for Stable Molecular Relational Learning IJCAI 2025 FlexMol: A Flexible Toolkit for Benchmarking Molecular Relational Learning NeurIPS 2024 MolTC: Towards Molecular Relational Modeling In Language Models ACL 2024 Conditional Graph Information Bottleneck for Molecular Relational Learning ICML 2023