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The Journal of Physical Chemistry. A|February 9, 2021
Accuracy of DLPNO-CCSD(T): Effect of Basis Set and System SizeIsolde Sandler, Junbo Chen, Mackenzie Taylor, et al.Chemistry (Weinheim an Der Bergstrasse, Germany)|October 18, 2018
Origin and Prediction of Highly Specific Bond Cleavage Sites in the Thermal Activation of Intact Protein IonsHuixin Wang, Michael G Leeming, Junming Ho, et al.The Journal of Physical Chemistry. A|December 4, 2024
How Accurate Are QM/MM Models?Junming Ho, Haibo Yu, Yihan Shao, et al.Journal of Computational Chemistry|April 19, 2025
The Effects of Conformational Sampling and QM Region Size in QM/MM Simulations: An Adaptive QM/MM Study With Model SystemsHolden Paz, Silvan Beck, Richmond Lee, et al.The Journal of Physical Chemistry. B|August 6, 2021
On the Accuracy of QM/MM Models: A Systematic Study of Intramolecular Proton Transfer Reactions of Amino Acids in WaterJunbo Chen, Jin Kato, Jason B Harper, et al.The Journal of Physical Chemistry. B|May 6, 2026
Phosphate Solvation in Mixed Organic-Aqueous Solutions: Implications for Marble Conservation TreatmentsRia H Stephenson, Jierui Zhang, Junming Ho, et al.The Journal of Physical Chemistry. A|October 19, 2010
First-principles prediction of the pK(a)s of anti-inflammatory oxicamsJunming Ho, Michelle L Coote, Marco Franco-Pérez, et al.Chemistry (Weinheim an Der Bergstrasse, Germany)|February 21, 2017
NHC-Catalyzed Metathesis and Phosphorylation Reactions of Disulfides: Development and Mechanistic InsightsReece D Crocker, Mohanad A Hussein, Junming Ho, et al.Scientific Reports|February 18, 2025
Carboxylate and coordination influence on the formation of an active RuV Oxo speciesJamal El-Abid, Kevin M Dorst, Andrew K Inge, et al.Physical Chemistry Chemical Physics : PCCP|September 12, 2019
Accelerated computation of free energy profile at ab initio quantum mechanical/molecular mechanical accuracy via a semi-empirical reference potential. II. Recalibrating semi-empirical parameters with force matchingXiaoliang Pan, Pengfei Li, Junming Ho, et al.Pageof 10