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Journal of Chemical Information and Modeling
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January 17, 2025
Normalized Protein-Ligand Distance Likelihood Score for End-to-End Blind Docking and Virtual Screening
Song Xia, Yaowen Gu, Yingkai Zhang
Interdisciplinary Sciences, Computational Life Sciences
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September 26, 2024
Empowering Graph Neural Network-Based Computational Drug Repositioning with Large Language Model-Inferred Knowledge Representation
Yaowen Gu, Zidu Xu, Carl Yang
Journal of Chemical Information and Modeling
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September 16, 2025
Bioactivity Deep Learning for Complex Structure-Free Compound-Protein Interaction Prediction
Yaowen Gu, Song Xia, Qi Ouyang, et al.
Chemical Research in Toxicology
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April 26, 2025
Enhancing Transthyretin Binding Affinity Prediction with a Consensus Model: Insights from the Tox24 Challenge
Xiaolin Pan, Yaowen Gu, Weijun Zhou, et al.
Computers in Biology and Medicine
|
February 22, 2023
MGREL: A multi-graph representation learning-based ensemble learning method for gene-disease association prediction
Ziyang Wang, Yaowen Gu, Si Zheng, et al.
Molecules (Basel, Switzerland)
|
August 26, 2023
Employing Molecular Conformations for Ligand-Based Virtual Screening with Equivariant Graph Neural Network and Deep Multiple Instance Learning
Yaowen Gu, Jiao Li, Hongyu Kang, et al.
Computers in Biology and Medicine
|
October 1, 2022
REDDA: Integrating multiple biological relations to heterogeneous graph neural network for drug-disease association prediction
Yaowen Gu, Si Zheng, Qijin Yin, et al.
Computers in Biology and Medicine
|
November 22, 2024
Deep multiple instance learning on heterogeneous graph for drug-disease association prediction
Yaowen Gu, Si Zheng, Bowen Zhang, et al.
Briefings in Bioinformatics
|
April 3, 2022
An efficient curriculum learning-based strategy for molecular graph learning
Yaowen Gu, Si Zheng, Zidu Xu, et al.
Frontiers in Pharmacology
|
June 7, 2023
Drug-disease association prediction with literature based multi-feature fusion
Hongyu Kang, Li Hou, Yaowen Gu, et al.
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of 2
Search research articles
Search
Showing results (1-10 of 16) with videos related to
Sort By:
Page
of 2
Journal of Chemical Information and Modeling
|
January 17, 2025
Normalized Protein-Ligand Distance Likelihood Score for End-to-End Blind Docking and Virtual Screening
Song Xia, Yaowen Gu, Yingkai Zhang
Interdisciplinary Sciences, Computational Life Sciences
|
September 26, 2024
Empowering Graph Neural Network-Based Computational Drug Repositioning with Large Language Model-Inferred Knowledge Representation
Yaowen Gu, Zidu Xu, Carl Yang
Journal of Chemical Information and Modeling
|
September 16, 2025
Bioactivity Deep Learning for Complex Structure-Free Compound-Protein Interaction Prediction
Yaowen Gu, Song Xia, Qi Ouyang, et al.
Chemical Research in Toxicology
|
April 26, 2025
Enhancing Transthyretin Binding Affinity Prediction with a Consensus Model: Insights from the Tox24 Challenge
Xiaolin Pan, Yaowen Gu, Weijun Zhou, et al.
Computers in Biology and Medicine
|
February 22, 2023
MGREL: A multi-graph representation learning-based ensemble learning method for gene-disease association prediction
Ziyang Wang, Yaowen Gu, Si Zheng, et al.
Molecules (Basel, Switzerland)
|
August 26, 2023
Employing Molecular Conformations for Ligand-Based Virtual Screening with Equivariant Graph Neural Network and Deep Multiple Instance Learning
Yaowen Gu, Jiao Li, Hongyu Kang, et al.
Computers in Biology and Medicine
|
October 1, 2022
REDDA: Integrating multiple biological relations to heterogeneous graph neural network for drug-disease association prediction
Yaowen Gu, Si Zheng, Qijin Yin, et al.
Computers in Biology and Medicine
|
November 22, 2024
Deep multiple instance learning on heterogeneous graph for drug-disease association prediction
Yaowen Gu, Si Zheng, Bowen Zhang, et al.
Briefings in Bioinformatics
|
April 3, 2022
An efficient curriculum learning-based strategy for molecular graph learning
Yaowen Gu, Si Zheng, Zidu Xu, et al.
Frontiers in Pharmacology
|
June 7, 2023
Drug-disease association prediction with literature based multi-feature fusion
Hongyu Kang, Li Hou, Yaowen Gu, et al.
Page
of 2