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PNAS Nexus
|
November 5, 2025
Stereochemistry-aware string-based molecular generation
Gary Tom, Edwin Yu, Naruki Yoshikawa, et al.
Journal of Cheminformatics
|
October 29, 2024
Towards the prediction of drug solubility in binary solvent mixtures at various temperatures using machine learning
Zeqing Bao, Gary Tom, Austin Cheng, et al.
Journal of Chemical Theory and Computation
|
August 15, 2024
Machine Learning Guided AQFEP: A Fast and Efficient Absolute Free Energy Perturbation Solution for Virtual Screening
Jordan E Crivelli-Decker, Zane Beckwith, Gary Tom, et al.
Advanced Materials (Deerfield Beach, Fla.)
|
May 25, 2024
In Silico Chemical Experiments in the Age of AI: From Quantum Chemistry to Machine Learning and Back
Abdulrahman Aldossary, Jorge Arturo Campos-Gonzalez-Angulo, Sergio Pablo-García, et al.
Science Advances
|
June 12, 2026
Quantitative prediction of siRNA complexation by ionizable drugs enables their codelivery in nanoparticles
Kai V Slaughter, Mickael Dang, Eric N Donders, et al.
Journal of the American Chemical Society
|
October 7, 2021
Polymer Dots with Enhanced Photostability, Quantum Yield, and Two-Photon Cross-Section using Structurally Constrained Deep-Blue Fluorophores
Don M Mayder, Christopher M Tonge, Giang D Nguyen, et al.
Chemical Reviews
|
August 13, 2024
Self-Driving Laboratories for Chemistry and Materials Science
Gary Tom, Stefan P Schmid, Sterling G Baird, et al.
Nature Computational Science
|
December 31, 2025
MATTERIX: toward a digital twin for robotics-assisted chemistry laboratory automation
Kourosh Darvish, Arjun Sohal, Abhijoy Mandal, et al.
Patterns (New York, N.Y.)
|
October 24, 2022
SELFIES and the future of molecular string representations
Mario Krenn, Qianxiang Ai, Senja Barthel, et al.
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Search research articles
Search
Showing results (1-10 of 9) with videos related to
Sort By:
Page
of 1
PNAS Nexus
|
November 5, 2025
Stereochemistry-aware string-based molecular generation
Gary Tom, Edwin Yu, Naruki Yoshikawa, et al.
Journal of Cheminformatics
|
October 29, 2024
Towards the prediction of drug solubility in binary solvent mixtures at various temperatures using machine learning
Zeqing Bao, Gary Tom, Austin Cheng, et al.
Journal of Chemical Theory and Computation
|
August 15, 2024
Machine Learning Guided AQFEP: A Fast and Efficient Absolute Free Energy Perturbation Solution for Virtual Screening
Jordan E Crivelli-Decker, Zane Beckwith, Gary Tom, et al.
Advanced Materials (Deerfield Beach, Fla.)
|
May 25, 2024
In Silico Chemical Experiments in the Age of AI: From Quantum Chemistry to Machine Learning and Back
Abdulrahman Aldossary, Jorge Arturo Campos-Gonzalez-Angulo, Sergio Pablo-García, et al.
Science Advances
|
June 12, 2026
Quantitative prediction of siRNA complexation by ionizable drugs enables their codelivery in nanoparticles
Kai V Slaughter, Mickael Dang, Eric N Donders, et al.
Journal of the American Chemical Society
|
October 7, 2021
Polymer Dots with Enhanced Photostability, Quantum Yield, and Two-Photon Cross-Section using Structurally Constrained Deep-Blue Fluorophores
Don M Mayder, Christopher M Tonge, Giang D Nguyen, et al.
Chemical Reviews
|
August 13, 2024
Self-Driving Laboratories for Chemistry and Materials Science
Gary Tom, Stefan P Schmid, Sterling G Baird, et al.
Nature Computational Science
|
December 31, 2025
MATTERIX: toward a digital twin for robotics-assisted chemistry laboratory automation
Kourosh Darvish, Arjun Sohal, Abhijoy Mandal, et al.
Patterns (New York, N.Y.)
|
October 24, 2022
SELFIES and the future of molecular string representations
Mario Krenn, Qianxiang Ai, Senja Barthel, et al.
Page
of 1