Rocio Mercado

The materials genome in action: identifying the performance limits for methane storage

Diego A. Gómez-Gualdrón, Maciej Haranczyk, Berend Smit, 2015 .

Practical notes on building molecular graph generative models

Ola Engkvist, Rocio Mercado, Esben Jannik Bjerrum, 2020 .

Graph networks for molecular design

Ola Engkvist, Rocio Mercado, Esben Jannik Bjerrum, 2020, Mach. Learn. Sci. Technol..

Comparative Study of Deep Generative Models on Chemical Space Coverage

Ola Engkvist, Rocio Mercado, J Zhang, 2020, J. Chem. Inf. Model..

Computer-Aided Search for Materials to Store Natural Gas for Vehicles

Maciej Haranczyk, Cory M. Simon, Jihan Kim, 2015, Front. Young Minds..

Systematic Tuning and Multifunctionalization of Covalent Organic Polymers for Enhanced Carbon Capture.

Wenchuan Wang, Maciej Haranczyk, Rocio Mercado, 2015, Journal of the American Chemical Society.

What Are the Best Materials To Separate a Xenon/Krypton Mixture?

Maciej Haranczyk, Cory M. Simon, Rocio Mercado, 2015 .