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Prediction of Solvate Based on Graph Attention Network 期刊论文
CRYSTAL GROWTH & DESIGN, 2025, 卷号: 25, 期号: 2
作者:  Sun, Shihui;  Wang, Jian-Rong;  Tang, Lei;  Fan, Zhehuan;  Li, Xutong
Adobe PDF(4799Kb)  |  收藏  |  浏览/下载:53/1  |  提交时间:2025/01/13
Mutation in CDC42 Gene Set as a Response Biomarker for Immune Checkpoint Inhibitor Therapy 期刊论文
CANCER MEDICINE, 2025, 卷号: 14, 期号: 1
作者:  Wang, Kun;  Zhang, Yingying;  Su, Zhaoming;  Wang, Bei;  Zhou, Yuanyang
Adobe PDF(6595Kb)  |  收藏  |  浏览/下载:116/1  |  提交时间:2025/01/20
Prediction of Multi-Pharmacokinetics Property in Multi-Species: Bayesian Neural Network Stacking Model with Uncertainty 期刊论文
MOLECULAR PHARMACEUTICS, 2024, 卷号: 21, 期号: 12
作者:  Zhang, Yuanyuan;  Xie, Zhiyin;  Xiao, Fu;  Yu, Jie;  Fan, Zhehuan
Adobe PDF(5565Kb)  |  收藏  |  浏览/下载:147/1  |  提交时间:2024/11/19
Generic protein-ligand interaction scoring by integrating physical prior knowledge and data augmentation modelling 期刊论文
NATURE MACHINE INTELLIGENCE, 2024, 卷号: 6, 期号: 6, 页码: 688-700
作者:  Cao, Duanhua;  Chen, Geng;  Jiang, Jiaxin;  Yu, Jie;  Zhang, Runze
Adobe PDF(3326Kb)  |  收藏  |  浏览/下载:187/0  |  提交时间:2024/06/17
Reducing overconfident errors in molecular property classification using Posterior Network 期刊论文
PATTERNS, 2024, 卷号: 5, 期号: 6
作者:  Fan, Zhehuan;  Yu, Jie;  Zhang, Xiang
Adobe PDF(2007Kb)  |  收藏  |  浏览/下载:142/0  |  提交时间:2024/06/07
Naringenin improves muscle endurance via activation of the Sp1-ERRg transcriptional axis 期刊论文
CELL REPORTS, 2023, 卷号: 42, 期号: 11
作者:  Lv, Zhenyu;  Meng, Jiao;  Yao, Sheng;  Xiao, Fu;  Li, Shilong
Adobe PDF(8823Kb)  |  收藏  |  浏览/下载:334/1  |  提交时间:2023/11/27
KinomeMETA: meta-learning enhanced kinome-wide polypharmacology profiling 期刊论文
BRIEFINGS IN BIOINFORMATICS, 2023
作者:  Qun Ren;  Ning Qu;  Jingjing Sun;  Jingyi Zhou;  Jin Liu
Adobe PDF(2916Kb)  |  收藏  |  浏览/下载:134/9  |  提交时间:2024/11/27
Computing the relative binding affinity of ligands based on a pairwise binding comparison network 期刊论文
NATURE COMPUTATIONAL SCIENCE, 2023, 卷号: 3, 期号: 10, 页码: 860-872
作者:  Yu, Jie;  Li, Zhaojun;  Chen, Geng;  Kong, Xiangtai;  Hu, Jie
Adobe PDF(3742Kb)  |  收藏  |  浏览/下载:449/123  |  提交时间:2023/11/10
Learning protein fitness landscapes with deep mutational scanning data from multiple sources 期刊论文
CELL SYSTEMS, 2023, 卷号: 14, 期号: 8
作者:  Chen, Lin;  Zhang, Zehong;  Li, Zhenghao;  Li, Rui;  Huo, Ruifeng
Adobe PDF(6402Kb)  |  收藏  |  浏览/下载:121/0  |  提交时间:2023/09/18
The Highly Operational Team (HOT) toward f-Block Materials 期刊论文
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 2023, 卷号: 62, 期号: 32
作者:  Park, Kyoung Chul;  Kittikhunnatham, Preecha;  Lim, Jaewoong;  Thaggard, Grace C.;  Liu, Yuan
Adobe PDF(385206Kb)  |  收藏  |  浏览/下载:392/3  |  提交时间:2024/03/04
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