Yi Zhuang

Implementation of Telescoping Boxes in Adaptive Steered Molecular Dynamics

S. Quirk, R. Hernandez, Nikhil Thota, 2022, Journal of chemical theory and computation.

Thermal Transport through Polymer-Linked Gold Nanoparticles.

R. Hernandez, Xingfei Wei, Yinong Zhao, 2022, The journal of physical chemistry. C, Nanomaterials and interfaces.

Energetics and structure of alanine-rich α-helices via adaptive steered molecular dynamics

S. Quirk, R. Hernandez, Ryan J Bucher, 2021, Biophysical journal.

Adaptive steered molecular dynamics of biomolecules

S. Quirk, R. Hernandez, Hailey R. Bureau, 2020 .

Building blocks for autonomous computing materials: Dimers, trimers, and tetramers.

R. Hernandez, Xingfei Wei, Yinong Zhao, 2021, The Journal of chemical physics.