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ADMETlab: a platform for systematic ADMET evaluation based on a comprehensively collected ADMET database

Journal of cheminformatics, 2018-06, Vol.10 (1), p.29-11, Article 29

2018

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ADME Properties Evaluation in Drug Discovery: Prediction of Caco‑2 Cell Permeability Using a Combination of NSGA-II and Boosting

Journal of chemical information and modeling, 2016-04, Vol.56 (4), p.763-773

2016

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PyBioMed: a python library for various molecular representations of chemicals, proteins and DNAs and their interactions

Journal of cheminformatics, 2018-03, Vol.10 (1), p.16-16, Article 16

2018

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TargetNet: a web service for predicting potential drug–target interaction profiling via multi-target SAR models

Journal of computer-aided molecular design, 2016-05, Vol.30 (5), p.413-424

2016

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The ups and downs of Poly(ADP-ribose) Polymerase-1 inhibitors in cancer therapy–Current progress and future direction

European journal of medicinal chemistry, 2020-10, Vol.203, p.112570-112570, Article 112570

2020

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ChemDes: an integrated web-based platform for molecular descriptor and fingerprint computation

Journal of cheminformatics, 2015-12, Vol.7 (1), Article 60

2015

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Improving Docking-Based Virtual Screening Ability by Integrating Multiple Energy Auxiliary Terms from Molecular Docking Scoring

Journal of chemical information and modeling, 2020-09, Vol.60 (9), p.4216-4230

2020

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Chemotaxonomic Classification Applied to the Identification of Two Closely-Related Citrus TCMs Using UPLC-Q-TOF-MS-Based Metabolomics

Molecules (Basel, Switzerland), 2017-10, Vol.22 (10), p.1721

2017

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Comprehensive comparison of polysaccharides from Ganoderma lucidum and G. sinense: chemical, antitumor, immunomodulating and gut-microbiota modulatory properties

Scientific reports, 2018-04, Vol.8 (1), p.6172-12, Article 6172

2018

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Improving structure-based virtual screening performance via learning from scoring function components

Briefings in bioinformatics, 2021-05, Vol.22 (3)

2021

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Curcumin Suppressed Activation of Dendritic Cells via JAK/STAT/SOCS Signal in Mice with Experimental Colitis

Frontiers in pharmacology, 2016-11, Vol.7, p.455-455

2016

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Proteomic profiling of dextran sulfate sodium induced acute ulcerative colitis mice serum exosomes and their immunomodulatory impact on macrophages

Proteomics (Weinheim), 2016-04, Vol.16 (7), p.1131-1145

2016

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HAMdb: a database of human autophagy modulators with specific pathway and disease information

Journal of cheminformatics, 2018-07, Vol.10 (1), p.34-8, Article 34

2018

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Current advances in ligand‐based target prediction

Wiley interdisciplinary reviews. Computational molecular science, 2021-05, Vol.11 (3), p.e1504-n/a

2021

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Machine learning to predict metabolic drug interactions related to cytochrome P450 isozymes

Journal of cheminformatics, 2022-04, Vol.14 (1), p.23-23, Article 23

2022

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Navigating Traditional Chinese Medicine Network Pharmacology and Computational Tools

Evidence-based complementary and alternative medicine, 2013-01, Vol.2013, p.731969-23

2013

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Uncovering the Complexity Mechanism of Different Formulas Treatment for Rheumatoid Arthritis Based on a Novel Network Pharmacology Model

Frontiers in pharmacology, 2020-07, Vol.11, p.1035-1035

2020

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ChemMORT: an automatic ADMET optimization platform using deep learning and multi-objective particle swarm optimization

Briefings in bioinformatics, 2024-01, Vol.25 (2)

2024

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MOST: most-similar ligand based approach to target prediction

BMC bioinformatics, 2017-03, Vol.18 (1), p.165-165, Article 165

2017

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BioMedR: an R/CRAN package for integrated data analysis pipeline in biomedical study

Briefings in bioinformatics, 2021-01, Vol.22 (1), p.474-484

2021

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ChemFLuo: a web-server for structure analysis and identification of fluorescent compounds

Briefings in bioinformatics, 2021-07, Vol.22 (4)

2021

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Semi-automated workflow for molecular pair analysis and QSAR-assisted transformation space expansion

Journal of cheminformatics, 2021-11, Vol.13 (1), p.86-86, Article 86

2021

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Curcumin improves regulatory T cells in gut-associated lymphoid tissue of colitis mice

World journal of gastroenterology : WJG, 2016-06, Vol.22 (23), p.5374-5383

2016

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Interference of Quercetin on Astragalus Polysaccharide-Induced Macrophage Activation

Molecules (Basel, Switzerland), 2018-06, Vol.23 (7), p.1563

2018

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A Novel Network Pharmacology Strategy to Decode Mechanism of Lang Chuang Wan in Treating Systemic Lupus Erythematosus

Frontiers in pharmacology, 2020-10, Vol.11, p.512877-512877

2020

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ADMETlab: a platform for systematic ADMET evaluation based on a comprehensively collected ADMET database

ADME Properties Evaluation in Drug Discovery: Prediction of Caco‑2 Cell Permeability Using a Combination of NSGA-II and Boosting

PyBioMed: a python library for various molecular representations of chemicals, proteins and DNAs and their interactions

TargetNet: a web service for predicting potential drug–target interaction profiling via multi-target SAR models

The ups and downs of Poly(ADP-ribose) Polymerase-1 inhibitors in cancer therapy–Current progress and future direction

ChemDes: an integrated web-based platform for molecular descriptor and fingerprint computation

Improving Docking-Based Virtual Screening Ability by Integrating Multiple Energy Auxiliary Terms from Molecular Docking Scoring

Chemotaxonomic Classification Applied to the Identification of Two Closely-Related Citrus TCMs Using UPLC-Q-TOF-MS-Based Metabolomics

Comprehensive comparison of polysaccharides from Ganoderma lucidum and G. sinense: chemical, antitumor, immunomodulating and gut-microbiota modulatory properties

Improving structure-based virtual screening performance via learning from scoring function components

Curcumin Suppressed Activation of Dendritic Cells via JAK/STAT/SOCS Signal in Mice with Experimental Colitis

Proteomic profiling of dextran sulfate sodium induced acute ulcerative colitis mice serum exosomes and their immunomodulatory impact on macrophages

HAMdb: a database of human autophagy modulators with specific pathway and disease information

Current advances in ligand‐based target prediction

Machine learning to predict metabolic drug interactions related to cytochrome P450 isozymes

Navigating Traditional Chinese Medicine Network Pharmacology and Computational Tools

Uncovering the Complexity Mechanism of Different Formulas Treatment for Rheumatoid Arthritis Based on a Novel Network Pharmacology Model

ChemMORT: an automatic ADMET optimization platform using deep learning and multi-objective particle swarm optimization

MOST: most-similar ligand based approach to target prediction

BioMedR: an R/CRAN package for integrated data analysis pipeline in biomedical study

ChemFLuo: a web-server for structure analysis and identification of fluorescent compounds

Semi-automated workflow for molecular pair analysis and QSAR-assisted transformation space expansion

Curcumin improves regulatory T cells in gut-associated lymphoid tissue of colitis mice

Interference of Quercetin on Astragalus Polysaccharide-Induced Macrophage Activation

A Novel Network Pharmacology Strategy to Decode Mechanism of Lang Chuang Wan in Treating Systemic Lupus Erythematosus

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