Lv21
102 积分 2025-09-16 加入
From text to insight: large language models for chemical data extraction
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ADvisor: An Open-Source Tool for Applicability Domain Definition and Optimization in Molecular Predictive Modeling
1个月前
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Combining GCN Structural Learning with LLM Chemical Knowledge for Enhanced Virtual Screening
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MultiCBlo: Enhancing predictions of compound-induced inhibition of cardiac ion channels with advanced multimodal learning
1个月前
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GraphDTA: predicting drug–target binding affinity with graph neural networks
1个月前
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PLANET: A Multi-objective Graph Neural Network Model for Protein–Ligand Binding Affinity Prediction
1个月前
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AI‐Driven De Novo Design of Ultra Long‐Acting GLP‐1 Receptor Agonists
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Self-supervised learning of molecular representations
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MolRWKV: Conditional Molecular Generation Model Using Local Enhancement and Graph Enhancement
1个月前
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Identification of antimicrobial peptides from the human gut microbiome using deep learning
1个月前
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