15th MEETING ON MOLECULAR SIMULATION 2025
INVITED SPEAKERS
NAME | INSTITUTION | ABSTRACT |
Erick Santiso |
North Carolina State University, USA | Modeling the Nucleation of Molecular Crystals |
Yamil Colón |
University of Notredame, USA | Machine Learning Guided MolecularSimulations of Gas Adsorption in Metal-Organic Frameworks |
Ubaldo Córdova | University of Puerto Rico, Puerto Rico | |
Adrián Díaz Acosta | Universidad de Granada, España | |
Gustavo Torres García | Universidad Autónoma del Estado de México | Influence of Reactive Sites on CO Loading Capacity in Monoethanolamine and 2-(Dimethylamino)ethanol: A Multiscale Analysis DFT and MD Simulations |
José Antonio Moreno Razo | UAM Iztapalapa | |
Orlando Guzmán López |
UAM Iztapalapa | |
José Alejandre |
UAM Iztapalapa | |
Alexander Pérez de la Luz | UAM Iztapalapa | |
Laura Domínguez Dueñas | UNAM, Facultad de Química | |
Alejandro Martínez Bojórquez |
Tecnológico de Monterrey, Campus León | Application of Monte Carlo simulations withMie potential to model adsorption isothermsin associating and non-associating fluids |
Juvencio Robles |
Universidad de Guanajuato, Campus Guanajuato | DynamicsMolecular Simulations to Design newDrugs Against Heart Failure |
Marco Antonio García Revilla |
Universidad de Guanajuato, Campus Guanajuato | |
Edith Nadir de Jesús González |
Universidad de Guanajuato, Campus León | Linear polyethylene: thermodynamic,mechanical and structural propertiesacross multiple resolutions |
Ponciano García Gutiérrez | UAM Iztapalapa | |