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Journal of the American Chemical Society|July 18, 2015
pH-Dependent Population Shift Regulates BACE1 Activity and InhibitionChristopher R Ellis, Jana Shen
Biorxiv : the Preprint Server for Biology|August 26, 2020
How μ-Opioid Receptor Recognizes FentanylQuynh N Vo, Paween Mahinthichaichan, Jana Shen, et al.
Research Square|September 16, 2020
How mu-Opioid Receptor Recognizes FentanylQuynh N Vo, Paween Mahinthichaichan, Jana Shen, et al.
JACS Au|January 3, 2022
Kinetics and Mechanism of Fentanyl Dissociation from the μ-Opioid ReceptorPaween Mahinthichaichan, Quynh N Vo, Christopher R Ellis, et al.
The Journal of Physical Chemistry Letters|February 25, 2016
Constant pH Molecular Dynamics Reveals pH-Modulated Binding of Two Small-Molecule BACE1 InhibitorsChristopher R Ellis, Cheng-Chieh Tsai, Xinjun Hou, et al.
Nature Communications|February 13, 2021
How μ-opioid receptor recognizes fentanylQuynh N Vo, Paween Mahinthichaichan, Jana Shen, et al.
The Journal of Physical Chemistry Letters|September 21, 2017
Proton-Coupled Conformational Allostery Modulates the Inhibitor Selectivity for β-SecretaseRobert C Harris, Cheng-Chieh Tsai, Christopher R Ellis, et al.
Journal of Computational Chemistry|April 4, 2017
Conformational dynamics of cathepsin D and binding to a small-molecule BACE1 inhibitorChristopher R Ellis, Cheng-Chieh Tsai, Fang-Yu Lin, et al.
Journal of Chemical Information and Modeling|March 28, 2023
Structure-Kinetics Relationships of Opioids from Metadynamics and Machine Learning AnalysisPaween Mahinthichaichan, Ruibin Liu, Quynh N Vo, et al.
Biorxiv : the Preprint Server for Biology|March 22, 2023
Structure-Kinetics Relationships of Opioids from Metadynamics and Machine LearningPaween Mahinthichaichan, Ruibin Liu, Quynh N Vo, et al.
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