Search

3 results in Authors: Lillian Chong

Theoretical and Computational Chemistry

Revisiting textbook azide-clock reactions: A “propeller-crawling” mechanism explains differences in rates

Anthony Bogetti, Matthew Zwier, Lillian Chong

Version 5 posted 24 April 2024

857

Downloads

Theoretical and Computational Chemistry

Mechanistic Insights into Passive Membrane Permeability of Drug-Like Molecules from a Weighted Ensemble of Trajectories

She Zhang, Jeff Thompson, Junchao Xia, Anthony Bogetti, Forrest York, Geoffrey Skillman, Lillian Chong, David LeBard

Version 1 posted 20 December 2021

544

Downloads

Theoretical and Computational Chemistry

Weighted Ensemble Simulation: Advances in methods, software, and applications

Lillian Chong, Daniel Zuckerman

Version 1 posted 13 May 2025

161

Downloads