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ACS Engineering Au
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June 22, 2026
PPO-GPR: A Custom Proximal Policy Optimization Tool for Active Reinforcement Learning
Etinosa Osaro, Yamil J Colón
Physical Chemistry Chemical Physics : PCCP
|
April 18, 2019
The effect of co-adsorbed solvent molecules on H<sub>2</sub> binding to metal alkoxides
Yamil J Colón, Randall Q Snurr
Chemical Society Reviews
|
April 30, 2014
High-throughput computational screening of metal-organic frameworks
Yamil J Colón, Randall Q Snurr
The Journal of Chemical Physics
|
February 22, 2023
Atomistic simulation of soft porous coordination polymers
James E Carpenter, Yamil J Colón
ACS Applied Materials & Interfaces
|
July 3, 2020
Transfer Learning Study of Gas Adsorption in Metal-Organic Frameworks
Ruimin Ma, Yamil J Colón, Tengfei Luo
Langmuir : the ACS Journal of Surfaces and Colloids
|
June 28, 2025
Expanding Cluster, Enhancing Adsorption: Investigating the Role of Electrostatic Configurations on Water Vapor Adsorption
Krishnendu Mukherjee, Mckayla Zastrow, Yamil J Colón
Chemical Communications (Cambridge, England)
|
August 14, 2014
Water adsorption in UiO-66: the importance of defects
Pritha Ghosh, Yamil J Colón, Randall Q Snurr
Chemical Science
|
June 24, 2021
Engineering entangled photon pairs with metal-organic frameworks
Rubén A Fritz, Yamil J Colón, Felipe Herrera
Journal of Chemical Theory and Computation
|
December 8, 2023
Boosting Graph Neural Networks with Molecular Mechanics: A Case Study of Sigma Profile Prediction
Dinis O Abranches, Edward J Maginn, Yamil J Colón
Proceedings of the National Academy of Sciences of the United States of America
|
July 23, 2024
Stochastic machine learning via sigma profiles to build a digital chemical space
Dinis O Abranches, Edward J Maginn, Yamil J Colón
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of 4
Search research articles
Search
Showing results (1-10 of 35) with videos related to
Sort By:
Page
of 4
ACS Engineering Au
|
June 22, 2026
PPO-GPR: A Custom Proximal Policy Optimization Tool for Active Reinforcement Learning
Etinosa Osaro, Yamil J Colón
Physical Chemistry Chemical Physics : PCCP
|
April 18, 2019
The effect of co-adsorbed solvent molecules on H<sub>2</sub> binding to metal alkoxides
Yamil J Colón, Randall Q Snurr
Chemical Society Reviews
|
April 30, 2014
High-throughput computational screening of metal-organic frameworks
Yamil J Colón, Randall Q Snurr
The Journal of Chemical Physics
|
February 22, 2023
Atomistic simulation of soft porous coordination polymers
James E Carpenter, Yamil J Colón
ACS Applied Materials & Interfaces
|
July 3, 2020
Transfer Learning Study of Gas Adsorption in Metal-Organic Frameworks
Ruimin Ma, Yamil J Colón, Tengfei Luo
Langmuir : the ACS Journal of Surfaces and Colloids
|
June 28, 2025
Expanding Cluster, Enhancing Adsorption: Investigating the Role of Electrostatic Configurations on Water Vapor Adsorption
Krishnendu Mukherjee, Mckayla Zastrow, Yamil J Colón
Chemical Communications (Cambridge, England)
|
August 14, 2014
Water adsorption in UiO-66: the importance of defects
Pritha Ghosh, Yamil J Colón, Randall Q Snurr
Chemical Science
|
June 24, 2021
Engineering entangled photon pairs with metal-organic frameworks
Rubén A Fritz, Yamil J Colón, Felipe Herrera
Journal of Chemical Theory and Computation
|
December 8, 2023
Boosting Graph Neural Networks with Molecular Mechanics: A Case Study of Sigma Profile Prediction
Dinis O Abranches, Edward J Maginn, Yamil J Colón
Proceedings of the National Academy of Sciences of the United States of America
|
July 23, 2024
Stochastic machine learning via sigma profiles to build a digital chemical space
Dinis O Abranches, Edward J Maginn, Yamil J Colón
Page
of 4