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Chemical Science
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November 21, 2024
FragGen: towards 3D geometry reliable fragment-based molecular generation
Odin Zhang, Yufei Huang, Shichen Cheng, et al.
Chemical Science
|
December 23, 2024
Correction: FragGen: towards 3D geometry reliable fragment-based molecular generation
Odin Zhang, Yufei Huang, Shicheng Chen, et al.
Briefings in Bioinformatics
|
January 3, 2024
Comprehensive assessment of protein loop modeling programs on large-scale datasets: prediction accuracy and efficiency
Tianyue Wang, Langcheng Wang, Xujun Zhang, et al.
Nature Protocols
|
June 24, 2026
Facilitating structure-based drug discovery with an artificial intelligence-driven virtual screening platform
Shukai Gu, Xujun Zhang, Mengwu Xiao, et al.
Journal of the American Chemical Society
|
January 13, 2026
MetalloDock: Decoding Metalloprotein-Ligand Interactions via Physics-Aware Deep Learning for Metalloprotein Drug Discovery
Hui Zhang, Xujun Zhang, Qun Su, et al.
Nature Computational Science
|
January 4, 2024
Efficient and accurate large library ligand docking with KarmaDock
Xujun Zhang, Odin Zhang, Chao Shen, et al.
Nature Communications
|
May 13, 2025
Token-Mol 1.0: tokenized drug design with large language models
Jike Wang, Rui Qin, Mingyang Wang, et al.
Nature Computational Science
|
October 15, 2025
ECloudGen: leveraging electron clouds as a latent variable to scale up structure-based molecular design
Odin Zhang, Jieyu Jin, Zhenxing Wu, et al.
Biorxiv : the Preprint Server for Biology
|
September 26, 2025
<i>De novo</i> Design of All-atom Biomolecular Interactions with RFdiffusion3
Jasper Butcher, Rohith Krishna, Raktim Mitra, et al.
Journal of Chemical Information and Modeling
|
June 26, 2024
DrugFlow: An AI-Driven One-Stop Platform for Innovative Drug Discovery
Chao Shen, Jianfei Song, Chang-Yu Hsieh, et al.
Page
of 4
Search research articles
Search
Showing results (21-30 of 32) with videos related to
Sort By:
Page
of 4
Chemical Science
|
November 21, 2024
FragGen: towards 3D geometry reliable fragment-based molecular generation
Odin Zhang, Yufei Huang, Shichen Cheng, et al.
Chemical Science
|
December 23, 2024
Correction: FragGen: towards 3D geometry reliable fragment-based molecular generation
Odin Zhang, Yufei Huang, Shicheng Chen, et al.
Briefings in Bioinformatics
|
January 3, 2024
Comprehensive assessment of protein loop modeling programs on large-scale datasets: prediction accuracy and efficiency
Tianyue Wang, Langcheng Wang, Xujun Zhang, et al.
Nature Protocols
|
June 24, 2026
Facilitating structure-based drug discovery with an artificial intelligence-driven virtual screening platform
Shukai Gu, Xujun Zhang, Mengwu Xiao, et al.
Journal of the American Chemical Society
|
January 13, 2026
MetalloDock: Decoding Metalloprotein-Ligand Interactions via Physics-Aware Deep Learning for Metalloprotein Drug Discovery
Hui Zhang, Xujun Zhang, Qun Su, et al.
Nature Computational Science
|
January 4, 2024
Efficient and accurate large library ligand docking with KarmaDock
Xujun Zhang, Odin Zhang, Chao Shen, et al.
Nature Communications
|
May 13, 2025
Token-Mol 1.0: tokenized drug design with large language models
Jike Wang, Rui Qin, Mingyang Wang, et al.
Nature Computational Science
|
October 15, 2025
ECloudGen: leveraging electron clouds as a latent variable to scale up structure-based molecular design
Odin Zhang, Jieyu Jin, Zhenxing Wu, et al.
Biorxiv : the Preprint Server for Biology
|
September 26, 2025
<i>De novo</i> Design of All-atom Biomolecular Interactions with RFdiffusion3
Jasper Butcher, Rohith Krishna, Raktim Mitra, et al.
Journal of Chemical Information and Modeling
|
June 26, 2024
DrugFlow: An AI-Driven One-Stop Platform for Innovative Drug Discovery
Chao Shen, Jianfei Song, Chang-Yu Hsieh, et al.
Page
of 4