Welcome to the Hernandez Lab!

The Hernandez lab uses-and-develops theoretical & computational chemistry to characterize nature. Our techniques include classical and semiclassical transition state theory, molecular dynamics, coarse-grained models, dynamical consistency, adaptive steered molecular dynamics (ASMD), and machine learning. Our applications include sustainable nanotechnology, autonomous computing, energetic materials, reactions in nonequilibrium solutions, and protein structure-and-function.