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Katie R. Mitchell-Koch
Katie R. Mitchell-Koch
Associate Professor of Chemistry, University of Manitoba
Подтвержден адрес электронной почты в домене umanitoba.ca
Название
Процитировано
Процитировано
Год
Utilization of hydrogen bonds to stabilize M− O (H) units: Synthesis and properties of monomeric iron and manganese complexes with terminal oxo and hydroxo ligands
CE MacBeth, R Gupta, KR Mitchell-Koch, VG Young Jr, GH Lushington, ...
Journal of the American Chemical Society 126 (8), 2556-2567, 2004
2202004
High-precision megahertz-to-terahertz dielectric spectroscopy of protein collective motions and hydration dynamics
A Charkhesht, CK Regmi, KR Mitchell-Koch, S Cheng, NQ Vinh
The Journal of Physical Chemistry B 122 (24), 6341-6350, 2018
762018
The study and application of biomolecules in deep eutectic solvents
JA Kist, H Zhao, KR Mitchell-Koch, GA Baker
Journal of Materials Chemistry B 9 (3), 536-566, 2021
732021
How does solvation layer mobility affect protein structural dynamics?
JN Dahanayake, KR Mitchell-Koch
Frontiers in molecular biosciences 5, 65, 2018
672018
Entropy connects water structure and dynamics in protein hydration layer
JN Dahanayake, KR Mitchell-Koch
Physical Chemistry Chemical Physics 20 (21), 14765-14777, 2018
602018
On the reorientation and hydrogen-bond dynamics of alcohols
AA Vartia, KR Mitchell-Koch, G Stirnemann, D Laage, WH Thompson
The Journal of Physical Chemistry B 115 (42), 12173-12178, 2011
572011
New insights into the dynamics of zwitterionic micelles and their hydration waters by gigahertz-to-terahertz dielectric spectroscopy
DK George, A Charkhesht, OA Hull, A Mishra, DGS Capelluto, ...
The Journal of Physical Chemistry B 120 (41), 10757-10767, 2016
382016
Progress in Our Understanding of 19F Chemical Shifts
JN Dahanayake, C Kasireddy, JP Karnes, R Verma, RM Steinert, ...
Annual Reports on NMR Spectroscopy 93, 281-365, 2018
312018
Molecular modeling of cetylpyridinium bromide, a cationic surfactant, in solutions and micelle
R Verma, A Mishra, KR Mitchell-Koch
Journal of chemical theory and computation 11 (11), 5415-5425, 2015
292015
Evaluating computational predictions of the relative stabilities of polymorphic pharmaceuticals
KR Mitchell-Koch, AJ Matzger
Journal of pharmaceutical sciences 97 (6), 2121-2129, 2008
252008
How important is entropy in determining the position-dependent free energy of a solute in a nanoconfined solvent?
KR Mitchell-Koch, WH Thompson
The Journal of Physical Chemistry C 111 (32), 11991-12001, 2007
252007
Demystifying fluorine chemical shifts: electronic structure calculations address origins of seemingly anomalous 19 F-NMR spectra of fluorohistidine isomers and analogues
C Kasireddy, JG Bann, KR Mitchell-Koch
Physical Chemistry Chemical Physics 17 (45), 30606-30612, 2015
242015
Protein Solvent Shell Structure Provides Rapid Analysis of Hydration Dynamics
JN Dahanayake, E Shahryari, KM Roberts, ME Heikes, C Kasireddy, ...
Journal of chemical information and modeling 59 (5), 2407-2422, 2019
232019
In silico studies of small molecule interactions with enzymes reveal aspects of catalytic function
R Verma, K Mitchell-Koch
Catalysts 7 (7), 212, 2017
232017
Tuning cationic micelle properties with an antioxidant additive: a molecular perspective
V Kumar, GM Sai, R Verma, KR Mitchell-Koch, D Ray, VK Aswal, ...
Langmuir 37 (15), 4611-4621, 2021
212021
To keep or not to keep? the question of crystallographic waters for enzyme simulations in organic solvent
JN Dahanayake, DN Gautam, R Verma, KR Mitchell-Koch
Molecular simulation 42 (12), 1001-1013, 2016
192016
Evaluating electronic structure methods for accurate calculation of 19F chemical shifts in fluorinated amino acids
JN Dahanayake, C Kasireddy, JM Ellis, D Hildebrandt, OA Hull, ...
Journal of computational chemistry 38 (30), 2605-2617, 2017
142017
Infrared Spectra of a Model Phenol-Amine Proton Transfer Complex in Nanoconfined CH3Cl
KR Mitchell-Koch, WH Thompson*
The Journal of Physical Chemistry B 112 (25), 7448-7459, 2008
142008
Self-assembly and micellar transition in CTAB solutions triggered by 1-Octanol
V Kumar, KR Mitchell-Koch, SG Marapureddy, R Verma, P Thareja, ...
The Journal of Physical Chemistry B 126 (40), 8102-8111, 2022
92022
Probing adaptation of hydration and protein dynamics to temperature
LC Doan, JN Dahanayake, KR Mitchell-Koch, AK Singh, NQ Vinh
ACS omega 7 (25), 22020-22031, 2022
72022
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Статьи 1–20