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 | 25 | 2018 |
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 | 23 | 2015 |
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 | 21 | 2019 |
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 | 13 | 2017 |
Newly identified C–H⋯ O hydrogen bond in histidine RM Steinert, C Kasireddy, ME Heikes, KR Mitchell-Koch Physical Chemistry Chemical Physics 24 (32), 19233-19251, 2022 | 7 | 2022 |
The biophysical probes 2-fluorohistidine and 4-fluorohistidine: spectroscopic signatures and molecular properties C Kasireddy, JM Ellis, JG Bann, KR Mitchell-Koch Scientific Reports 7 (1), 42651, 2017 | 6 | 2017 |
Tautomeric stabilities of 4-fluorohistidine shed new light on mechanistic experiments with labeled ribonuclease A C Kasireddy, JM Ellis, JG Bann, KR Mitchell-Koch Chemical physics letters 666, 58-61, 2016 | 5 | 2016 |
Newly identified C-HMIDLINE HORIZONTAL ELLIPSISO hydrogen bond in histidine RM Steinert, C Kasireddy, ME Heikes, KR Mitchell-Koch PHYSICAL CHEMISTRY CHEMICAL PHYSICS 24 (32), 19233-19251, 2022 | | 2022 |
Rapid evaluation of protein hydration layer dynamics using hydration shell structure J Dahanayake, E Shahryari, K Roberts, M Heikes, C Kasireddy, ... ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 258, 2019 | | 2019 |
Understanding Fluorine Chemical Shifts and the Molecular Properties of Organic Molecules C Kasireddy Wichita State University, 2018 | | 2018 |
Electronic structure calculations aid in the interpretation of 19F NMR chemical shifts C Kasireddy, J Bann, K Mitchell-Koch ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 251, 2016 | | 2016 |
Electronic structure calculations of fluorohistidine isomers C Kasireddy, JG Bann, KR Mitchell-Koch ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 248, 2014 | | 2014 |
Computational Studies on Tautomers of Fluorinated-Histidine and Fluorinated-Imidazole C Kasireddy | | |