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Plos Computational Biology
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February 10, 2022
Machine learning modeling of family wide enzyme-substrate specificity screens
Samuel Goldman, Ria Das, Kevin K Yang, et al.
ACS Central Science
|
July 3, 2019
Learning Retrosynthetic Planning through Simulated Experience
John S Schreck, Connor W Coley, Kyle J M Bishop
Chemical Society Reviews
|
May 22, 2026
An overview of reaction outcome prediction with physics-based and data-driven methods
Joonyoung F Joung, Nicholas Casetti, Priyanka Raghavan, et al.
The Journal of Chemical Physics
|
November 27, 2024
Comment on "Molecular hypergraph neural networks" [J. Chem. Phys. 160, 144307 (2024)]
Nicholas Casetti, Pragnay Nevatia, Junwu Chen, et al.
Journal of Visualized Experiments : Jove
|
May 29, 2018
A Modular Microfluidic Technology for Systematic Studies of Colloidal Semiconductor Nanocrystals
Robert W Epps, Kobi C Felton, Connor W Coley, et al.
Digital Discovery
|
August 19, 2024
Extracting structured data from organic synthesis procedures using a fine-tuned large language model
Qianxiang Ai, Fanwang Meng, Jiale Shi, et al.
Journal of Chemical Information and Modeling
|
January 9, 2018
SCScore: Synthetic Complexity Learned from a Reaction Corpus
Connor W Coley, Luke Rogers, William H Green, et al.
Lab on a Chip
|
October 25, 2017
Automated microfluidic platform for systematic studies of colloidal perovskite nanocrystals: towards continuous nano-manufacturing
Robert W Epps, Kobi C Felton, Connor W Coley, et al.
Journal of Chemical Information and Modeling
|
July 25, 2020
Uncertainty Quantification Using Neural Networks for Molecular Property Prediction
Lior Hirschfeld, Kyle Swanson, Kevin Yang, et al.
Journal of Chemical Information and Modeling
|
June 27, 2023
RxnScribe: A Sequence Generation Model for Reaction Diagram Parsing
Yujie Qian, Jiang Guo, Zhengkai Tu, et al.
Page
of 12
Search research articles
Search
Showing results (41-50 of 113) with videos related to
Sort By:
Page
of 12
Plos Computational Biology
|
February 10, 2022
Machine learning modeling of family wide enzyme-substrate specificity screens
Samuel Goldman, Ria Das, Kevin K Yang, et al.
ACS Central Science
|
July 3, 2019
Learning Retrosynthetic Planning through Simulated Experience
John S Schreck, Connor W Coley, Kyle J M Bishop
Chemical Society Reviews
|
May 22, 2026
An overview of reaction outcome prediction with physics-based and data-driven methods
Joonyoung F Joung, Nicholas Casetti, Priyanka Raghavan, et al.
The Journal of Chemical Physics
|
November 27, 2024
Comment on "Molecular hypergraph neural networks" [J. Chem. Phys. 160, 144307 (2024)]
Nicholas Casetti, Pragnay Nevatia, Junwu Chen, et al.
Journal of Visualized Experiments : Jove
|
May 29, 2018
A Modular Microfluidic Technology for Systematic Studies of Colloidal Semiconductor Nanocrystals
Robert W Epps, Kobi C Felton, Connor W Coley, et al.
Digital Discovery
|
August 19, 2024
Extracting structured data from organic synthesis procedures using a fine-tuned large language model
Qianxiang Ai, Fanwang Meng, Jiale Shi, et al.
Journal of Chemical Information and Modeling
|
January 9, 2018
SCScore: Synthetic Complexity Learned from a Reaction Corpus
Connor W Coley, Luke Rogers, William H Green, et al.
Lab on a Chip
|
October 25, 2017
Automated microfluidic platform for systematic studies of colloidal perovskite nanocrystals: towards continuous nano-manufacturing
Robert W Epps, Kobi C Felton, Connor W Coley, et al.
Journal of Chemical Information and Modeling
|
July 25, 2020
Uncertainty Quantification Using Neural Networks for Molecular Property Prediction
Lior Hirschfeld, Kyle Swanson, Kevin Yang, et al.
Journal of Chemical Information and Modeling
|
June 27, 2023
RxnScribe: A Sequence Generation Model for Reaction Diagram Parsing
Yujie Qian, Jiang Guo, Zhengkai Tu, et al.
Page
of 12