Youjun Xu

发表

Automatic Retrosynthetic Pathway Planning Using Template-free Models

Kangjie Lin, Youjun Xu, Jianfeng Pei, 2019, 1906.02308.

Youjun Xu, Jianfeng Pei, L. Lai, 2020, Journal of medicinal chemistry.

Prediction of COVID-19 Severity Using Chest Computed Tomography and Laboratory Measurements: Evaluation Using a Machine Learning Approach

Youjun Xu, Daowei Li, Qiang Zhang, 2020, JMIR medical informatics.

Prediction of liquid-liquid phase separation proteins using machine learning

Youjun Xu, Jianfeng Pei, L. Lai, 2019, bioRxiv.

Self-Learning Perfect Optical Chirality via a Deep Neural Network.

Feng Lin, Youjun Xu, Cheng Chi, 2019, Physical review letters.

MolMiner: You only look once for chemical structure recognition

Youjun Xu, Jianfeng Pei, Weilin Zhang, 2022, J. Chem. Inf. Model..

Deep Learning Model of Dock by Dock Process Signi cantly Accelerate the Process of Docking- Based Virtual Screening

Youjun Xu, Wei Ma, Jianhang Zhang, 2021 .

NF-κB signaling and cell-fate decision induced by a fast-dissociating tumor necrosis factor mutant.

Youjun Xu, L. Lai, Bo Tang, 2017, Biochemical and biophysical research communications.

A transferable deep learning approach to fast screen potential antiviral drugs against SARS-CoV-2

Youjun Xu, Luhua Lai, Qi Sun, 2020, bioRxiv.

Deep Learning for Drug-Induced Liver Injury

Luhua Lai, Jianfeng Pei, Youjun Xu, 2015, J. Chem. Inf. Model..

CavityPlus: a web server for protein cavity detection with pharmacophore modelling, allosteric site identification and covalent ligand binding ability prediction

Weilin Zhang, Luhua Lai, Jianfeng Pei, 2018, Nucleic Acids Res..

Deep Learning Based Regression and Multiclass Models for Acute Oral Toxicity Prediction with Automatic Chemical Feature Extraction

Jianfeng Pei, Youjun Xu, Luhua Lai, 2017, J. Chem. Inf. Model..

Deep learning for molecular generation.

Jianfeng Pei, Youjun Xu, Kangjie Lin, 2019, Future medicinal chemistry.

CavitySpace: A Database of Potential Ligand Binding Sites in the Human Proteome

Youjun Xu, Jianfeng Pei, L. Lai, 2022, bioRxiv.

QuoteTarget: A sequence‐based transformer protein language model to identify potentially druggable protein targets

Minghua Deng, Youjun Xu, Jianfeng Pei, 2022, Protein science : a publication of the Protein Society.

Prediction of Human Cytochrome P450 Inhibition Using a Multitask Deep Autoencoder Neural Network.

Jianfeng Pei, Youjun Xu, Luhua Lai, 2018, Molecular pharmaceutics.

Uncovering the Dominant Motion Modes of Allosteric Regulation Improves Allosteric Site Prediction

Minghua Deng, Youjun Xu, L. Lai, 2021, J. Chem. Inf. Model..

miDruglikeness: Subdivisional Drug-Likeness Prediction Models Using Active Ensemble Learning Strategies

Youjun Xu, Jianfeng Pei, L. Lai, 2022, Biomolecules.

Efficient molecular encoders for virtual screening.

Shiwei Wang, Jianfeng Pei, Youjun Xu, 2019, Drug discovery today. Technologies.

Deep Learning Based Regression and Multiclass Models for Acute Oral Toxicity Prediction with Automatic Chemical Feature Extraction

Luhua Lai, Jianfeng Pei, Youjun Xu, 2017, J. Chem. Inf. Model..

Deep Learning Model of Dock by Dock Process Significantly Accelerate the Process of Docking-Based Virtual Screening

Beijing, Technology, China., 2021, 2110.10918.

Accelerating Discovery of Novel and Bioactive Ligands With Pharmacophore-Informed Generative Models

Youjun Xu, Jianfeng Pei, Jianhang Zhang, 2024, 2401.01059.

Prediction of liquid–liquid phase separating proteins using machine learning

Youjun Xu, Jianfeng Pei, L. Lai, 2022, BMC Bioinformatics.

Automatic retrosynthetic route planning using template-free models

Jianfeng Pei, Youjun Xu, Kangjie Lin, 2020, Chemical science.

Prediction of COVID-19 Severity Using Chest Computed Tomography and Laboratory Measurements: Evaluation Using a Machine Learning Approach (Preprint)

Youjun Xu, Daowei Li, Qiang Zhang, 2020 .