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molecular representation

Papers

Showing 101110 of 168 papers

TitleStatusHype
Image-Like Graph Representations for Improved Molecular Property Prediction0
Improving Performance Prediction of Electrolyte Formulations with Transformer-based Molecular Representation Model0
Integrating Chemical Language and Molecular Graph in Multimodal Fused Deep Learning for Drug Property Prediction0
Knowledge-aware contrastive heterogeneous molecular graph learning0
Knowledge-aware Contrastive Molecular Graph Learning0
Knowledge graph-enhanced molecular contrastive learning with functional prompt0
Learning multi-scale functional representations of proteins from single-cell microscopy data0
Learning Multi-view Molecular Representations with Structured and Unstructured Knowledge0
Generation of 3D Molecules in Pockets via Language Model0
LiteGEM: Lite Geometry Enhanced Molecular Representation Learning for Quantum Property Prediction0
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