Bioinformatics | Drug Discovery SadNet: a novel multimodal fusion network for protein-ligand binding affinity prediction. April 16, 2024
Biochemistry | Computational Biology | Drug Discovery Enhancing Generalizability in Protein-Ligand Binding Affinity Prediction with Multimodal Contrastive Learning. March 5, 2024
Biochemistry | Biophysics | Computational Chemistry Exploring protein-ligand binding affinity prediction with electron density-based geometric deep learning. February 5, 2024
Bioinformatics | Computational Biology | Drug Discovery | Pharmacology ResBiGAAT: Residual Bi-GRU with attention for protein-ligand binding affinity prediction. October 22, 2023
Bioinformatics | Molecular Biology | Pharmacology Water Network-Augmented Two-State Model for Protein-Ligand Binding Affinity Prediction. July 11, 2023
Drug design | Pharmacology ArkDTA: attention regularization guided by non-covalent interactions for explainable drug-target binding affinity prediction. June 30, 2023
Bioinformatics | Drug Discovery GraphscoreDTA: optimized graph neural network for protein-ligand binding affinity prediction. May 24, 2023
Bioinformatics | Computational Biology HAC-Net: A Hybrid Attention-Based Convolutional Neural Network for Highly Accurate Protein-Ligand Binding Affinity Prediction. March 29, 2023
Bioinformatics | Drug design | Pharmacology Protein-ligand binding affinity prediction with edge awareness and supervised attention. January 24, 2023
Drug Discovery | Structural Bioinformatics | Structural Biology Leveraging scaffold information to predict protein-ligand binding affinity with an empirical graph neural network. January 10, 2023
Bioinformatics | Computational Chemistry | Pharmacology A New Hybrid Neural Network Deep Learning Method for Protein-Ligand Binding Affinity Prediction and De Novo Drug Design. November 26, 2022
Bioinformatics | Computer Science | Drug Discovery DLSSAffinity: protein-ligand binding affinity prediction a deep learning model. April 13, 2022