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Bioinformatics (Oxford, England)
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May 19, 2021
DeepChargePredictor: a web server for predicting QM-based atomic charges via state-of-the-art machine-learning algorithms
Jike Wang, Huiyong Sun, Jiawen Chen, et al.
Journal of Medicinal Chemistry
|
August 2, 2022
Boosting Protein-Ligand Binding Pose Prediction and Virtual Screening Based on Residue-Atom Distance Likelihood Potential and Graph Transformer
Chao Shen, Xujun Zhang, Yafeng Deng, et al.
JACS Au
|
June 30, 2023
Uncovering the Kinetic Characteristics and Degradation Preference of PROTAC Systems with Advanced Theoretical Analyses
Rongfan Tang, Zhe Wang, Sutong Xiang, et al.
Research (Washington, D.C.)
|
June 21, 2023
Deciphering the Shared and Specific Drug Resistance Mechanisms of Anaplastic Lymphoma Kinase via Binding Free Energy Computation
Yang Yu, Zhe Wang, Lingling Wang, et al.
European Journal of Medicinal Chemistry
|
May 4, 2025
Corrigendum to "Discovery of novel tetrahydroquinoline derivatives as potent, selective, and orally Available AR antagonists" [Eur. J. Med. Chem. 291 (2025) 117566]
Leer Yuan, Jianing Liao, Yiyang Qin, et al.
Journal of Cheminformatics
|
November 1, 2017
Comparative analyses of structural features and scaffold diversity for purchasable compound libraries
Jun Shang, Huiyong Sun, Hui Liu, et al.
Journal of Cheminformatics
|
July 4, 2023
TB-IECS: an accurate machine learning-based scoring function for virtual screening
Xujun Zhang, Chao Shen, Dejun Jiang, et al.
Briefings in Bioinformatics
|
May 22, 2021
DeepAtomicCharge: a new graph convolutional network-based architecture for accurate prediction of atomic charges
Jike Wang, Dongsheng Cao, Cunchen Tang, et al.
Scientific Reports
|
November 24, 2016
In Silico Exploration for Novel Type-I Inhibitors of Tie-2/TEK: The Performance of Different Selection Strategy in Selecting Virtual Screening Candidates
Peichen Pan, Huiyong Sun, Hui Liu, et al.
Journal of Chemical Information and Modeling
|
February 26, 2010
Structure-based design of peptides against G3BP with cytotoxicity on tumor cells
Wei Cui, Zhuo Wei, Quan Chen, et al.
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of 47
Search research articles
Search
Showing results (241-250 of 464) with videos related to
Sort By:
Page
of 47
Bioinformatics (Oxford, England)
|
May 19, 2021
DeepChargePredictor: a web server for predicting QM-based atomic charges via state-of-the-art machine-learning algorithms
Jike Wang, Huiyong Sun, Jiawen Chen, et al.
Journal of Medicinal Chemistry
|
August 2, 2022
Boosting Protein-Ligand Binding Pose Prediction and Virtual Screening Based on Residue-Atom Distance Likelihood Potential and Graph Transformer
Chao Shen, Xujun Zhang, Yafeng Deng, et al.
JACS Au
|
June 30, 2023
Uncovering the Kinetic Characteristics and Degradation Preference of PROTAC Systems with Advanced Theoretical Analyses
Rongfan Tang, Zhe Wang, Sutong Xiang, et al.
Research (Washington, D.C.)
|
June 21, 2023
Deciphering the Shared and Specific Drug Resistance Mechanisms of Anaplastic Lymphoma Kinase via Binding Free Energy Computation
Yang Yu, Zhe Wang, Lingling Wang, et al.
European Journal of Medicinal Chemistry
|
May 4, 2025
Corrigendum to "Discovery of novel tetrahydroquinoline derivatives as potent, selective, and orally Available AR antagonists" [Eur. J. Med. Chem. 291 (2025) 117566]
Leer Yuan, Jianing Liao, Yiyang Qin, et al.
Journal of Cheminformatics
|
November 1, 2017
Comparative analyses of structural features and scaffold diversity for purchasable compound libraries
Jun Shang, Huiyong Sun, Hui Liu, et al.
Journal of Cheminformatics
|
July 4, 2023
TB-IECS: an accurate machine learning-based scoring function for virtual screening
Xujun Zhang, Chao Shen, Dejun Jiang, et al.
Briefings in Bioinformatics
|
May 22, 2021
DeepAtomicCharge: a new graph convolutional network-based architecture for accurate prediction of atomic charges
Jike Wang, Dongsheng Cao, Cunchen Tang, et al.
Scientific Reports
|
November 24, 2016
In Silico Exploration for Novel Type-I Inhibitors of Tie-2/TEK: The Performance of Different Selection Strategy in Selecting Virtual Screening Candidates
Peichen Pan, Huiyong Sun, Hui Liu, et al.
Journal of Chemical Information and Modeling
|
February 26, 2010
Structure-based design of peptides against G3BP with cytotoxicity on tumor cells
Wei Cui, Zhuo Wei, Quan Chen, et al.
Page
of 47