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molecular representation

Papers

Showing 111120 of 168 papers

TitleStatusHype
Mayer-homology learning prediction of protein-ligand binding affinities0
May the Force be with You: Unified Force-Centric Pre-Training for 3D Molecular Conformations0
Meta-QSAR: a large-scale application of meta-learning to drug design and discovery0
Multilingual Molecular Representation Learning via Contrastive Pre-training0
MolCAP: Molecular Chemical reActivity pretraining and prompted-finetuning enhanced molecular representation learning0
MolCPT: Molecule Continuous Prompt Tuning to Generalize Molecular Representation Learning0
Molecular design method based on novel molecular representation and variational auto-encoder0
Molecular Joint Representation Learning via Multi-modal Information0
MultiModal-Learning for Predicting Molecular Properties: A Framework Based on Image and Graph Structures0
Multi-Modal Molecular Representation Learning via Structure Awareness0
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