Bolek injects Morgan fingerprint embeddings into an instruction-tuned text model, then fine-tunes on molecular alignment and synthetic chain-of-thought tasks to improve performance and grounding on 15 TDC binary classification endpoints while generalizing to unseen tasks.
GIT-Mol: A multi-modal large language model for molecular science with graph, image, and text.Computers in Biology and Medicine, 171:108073
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GLACIER combines graph, SMILES, and descriptor encoders with Finsler fusion and contrastive distillation to produce an efficient multimodal model for molecular property prediction.
citing papers explorer
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Bolek: A Multimodal Language Model for Molecular Reasoning
Bolek injects Morgan fingerprint embeddings into an instruction-tuned text model, then fine-tunes on molecular alignment and synthetic chain-of-thought tasks to improve performance and grounding on 15 TDC binary classification endpoints while generalizing to unseen tasks.
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GLACIER: A Multimodal Student-Teacher Foundation Model for Molecular Property Prediction
GLACIER combines graph, SMILES, and descriptor encoders with Finsler fusion and contrastive distillation to produce an efficient multimodal model for molecular property prediction.