134 related articles for article (PubMed ID: 38366974)
1. graphLambda: Fusion Graph Neural Networks for Binding Affinity Prediction.
Mqawass G; Popov P
J Chem Inf Model; 2024 Apr; 64(7):2323-2330. PubMed ID: 38366974
[TBL] [Abstract][Full Text] [Related]
2. Sfcnn: a novel scoring function based on 3D convolutional neural network for accurate and stable protein-ligand affinity prediction.
Wang Y; Wei Z; Xi L
BMC Bioinformatics; 2022 Jun; 23(1):222. PubMed ID: 35676617
[TBL] [Abstract][Full Text] [Related]
3. AK-Score: Accurate Protein-Ligand Binding Affinity Prediction Using an Ensemble of 3D-Convolutional Neural Networks.
Kwon Y; Shin WH; Ko J; Lee J
Int J Mol Sci; 2020 Nov; 21(22):. PubMed ID: 33182567
[TBL] [Abstract][Full Text] [Related]
4. Development of a graph convolutional neural network model for efficient prediction of protein-ligand binding affinities.
Son J; Kim D
PLoS One; 2021; 16(4):e0249404. PubMed ID: 33831016
[TBL] [Abstract][Full Text] [Related]
5. Graph Convolutional Neural Networks for Predicting Drug-Target Interactions.
Torng W; Altman RB
J Chem Inf Model; 2019 Oct; 59(10):4131-4149. PubMed ID: 31580672
[TBL] [Abstract][Full Text] [Related]
6. Ligand binding affinity prediction with fusion of graph neural networks and 3D structure-based complex graph.
Dong L; Shi S; Qu X; Luo D; Wang B
Phys Chem Chem Phys; 2023 Sep; 25(35):24110-24120. PubMed ID: 37655493
[TBL] [Abstract][Full Text] [Related]
7. Enhancing Generalizability in Protein-Ligand Binding Affinity Prediction with Multimodal Contrastive Learning.
Luo D; Liu D; Qu X; Dong L; Wang B
J Chem Inf Model; 2024 Mar; 64(6):1892-1906. PubMed ID: 38441880
[TBL] [Abstract][Full Text] [Related]
8. Leveraging scaffold information to predict protein-ligand binding affinity with an empirical graph neural network.
Xia C; Feng SH; Xia Y; Pan X; Shen HB
Brief Bioinform; 2023 Jan; 24(1):. PubMed ID: 36627113
[TBL] [Abstract][Full Text] [Related]
9. Complex machine learning model needs complex testing: Examining predictability of molecular binding affinity by a graph neural network.
Nikolaienko T; Gurbych O; Druchok M
J Comput Chem; 2022 Apr; 43(10):728-739. PubMed ID: 35201629
[TBL] [Abstract][Full Text] [Related]
10. GraphscoreDTA: optimized graph neural network for protein-ligand binding affinity prediction.
Wang K; Zhou R; Tang J; Li M
Bioinformatics; 2023 Jun; 39(6):. PubMed ID: 37225408
[TBL] [Abstract][Full Text] [Related]
11. Drug-target affinity prediction with extended graph learning-convolutional networks.
Qi H; Yu T; Yu W; Liu C
BMC Bioinformatics; 2024 Feb; 25(1):75. PubMed ID: 38365583
[TBL] [Abstract][Full Text] [Related]
12. HAC-Net: A Hybrid Attention-Based Convolutional Neural Network for Highly Accurate Protein-Ligand Binding Affinity Prediction.
Kyro GW; Brent RI; Batista VS
J Chem Inf Model; 2023 Apr; 63(7):1947-1960. PubMed ID: 36988912
[TBL] [Abstract][Full Text] [Related]
13. ResBiGAAT: Residual Bi-GRU with attention for protein-ligand binding affinity prediction.
Aly Abdelkader G; Ngnamsie Njimbouom S; Oh TJ; Kim JD
Comput Biol Chem; 2023 Dec; 107():107969. PubMed ID: 37866117
[TBL] [Abstract][Full Text] [Related]
14. Visualizing convolutional neural network protein-ligand scoring.
Hochuli J; Helbling A; Skaist T; Ragoza M; Koes DR
J Mol Graph Model; 2018 Sep; 84():96-108. PubMed ID: 29940506
[TBL] [Abstract][Full Text] [Related]
15. A Cascade Graph Convolutional Network for Predicting Protein-Ligand Binding Affinity.
Shen H; Zhang Y; Zheng C; Wang B; Chen P
Int J Mol Sci; 2021 Apr; 22(8):. PubMed ID: 33919681
[TBL] [Abstract][Full Text] [Related]
16. Improved Protein-Ligand Binding Affinity Prediction with Structure-Based Deep Fusion Inference.
Jones D; Kim H; Zhang X; Zemla A; Stevenson G; Bennett WFD; Kirshner D; Wong SE; Lightstone FC; Allen JE
J Chem Inf Model; 2021 Apr; 61(4):1583-1592. PubMed ID: 33754707
[TBL] [Abstract][Full Text] [Related]
17. Task-Specific Scoring Functions for Predicting Ligand Binding Poses and Affinity and for Screening Enrichment.
Ashtawy HM; Mahapatra NR
J Chem Inf Model; 2018 Jan; 58(1):119-133. PubMed ID: 29190087
[TBL] [Abstract][Full Text] [Related]
18. CurvAGN: Curvature-based Adaptive Graph Neural Networks for Predicting Protein-Ligand Binding Affinity.
Wu J; Chen H; Cheng M; Xiong H
BMC Bioinformatics; 2023 Oct; 24(1):378. PubMed ID: 37798653
[TBL] [Abstract][Full Text] [Related]
19. Graph Convolutional Capsule Regression (GCCR): A Model for Accelerated Filtering of Novel Potential Candidates for SARS-CoV-2 based on Binding Affinity.
Krishnan A; Vinod D
Curr Comput Aided Drug Des; 2024; 20(1):33-41. PubMed ID: 37005531
[TBL] [Abstract][Full Text] [Related]
20. Ligand Binding Prediction Using Protein Structure Graphs and Residual Graph Attention Networks.
Pandey M; Radaeva M; Mslati H; Garland O; Fernandez M; Ester M; Cherkasov A
Molecules; 2022 Aug; 27(16):. PubMed ID: 36014351
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]
