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McCullagh, Martin
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1

Motif-VI loop acts as a nucleotide valve in the West Nile V..:

Roy, Priti ; Walter, Zachary ; Berish, Lauren..
Nucleic Acids Research.  , 2024
Link: https://doi.org/10.1093/..
 
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2

Quantifying Unbiased Conformational Ensembles from Biased S..:

Sasmal, Subarna ; Pal, Triasha ; Hocky, Glen M..
Journal of Chemical Theory and Computation.  20 (2024)  9 - p. 3492-3502 , 2024
Link: https://doi.org/10.1021/..
 
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3

The role of ATP hydrolysis and product release in the trans..:

Roy, Priti ; Lawal, Monsurat M. ; McCullagh, Martin
Biophysical Journal.  123 (2024)  3 - p. 341a , 2024
Link: https://doi.org/10.1016/..
 
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4

What is allosteric regulation? Exploring the exceptions tha..:

McCullagh, Martin ; Zeczycki, Tonya N. ; Kariyawasam, Chathuri S....
Journal of Biological Chemistry.  300 (2024)  3 - p. 105672 , 2024
Link: https://doi.org/10.1016/..
 
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5

Role of ATP Hydrolysis and Product Release in the Transloca..:

Lawal, Monsurat M. ; Roy, Priti ; McCullagh, Martin
The Journal of Physical Chemistry B.  128 (2024)  2 - p. 492-503 , 2024
Link: https://doi.org/10.1021/..
 
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6

Learning reaction coordinates for enhanced sampling directl..:

Sasmal, Subarna ; McCullagh, Martin ; Hocky, Glen M.
Biophysical Journal.  122 (2023)  3 - p. 335a , 2023
Link: https://doi.org/10.1016/..
 
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7

Reaction Coordinates for Conformational Transitions Using L..:

Sasmal, Subarna ; McCullagh, Martin ; Hocky, Glen M.
Journal of Chemical Theory and Computation.  19 (2023)  14 - p. 4427-4435 , 2023
Link: https://doi.org/10.1021/..
 
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8

Size-and-Shape Space Gaussian Mixture Models for Structural..:

Klem, Heidi ; Hocky, Glen M. ; McCullagh, Martin
Journal of Chemical Theory and Computation.  18 (2022)  5 - p. 3218-3230 , 2022
Link: https://doi.org/10.1021/..
 
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9

Modeling Catalysis in Allosteric Enzymes: Capturing Conform..:

Klem, Heidi ; McCullagh, Martin ; Paton, Robert S.
Topics in Catalysis.  65 (2021)  1-4 - p. 165-186 , 2021
Link: https://doi.org/10.1007/..
 
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10

Conserved motifs in the flavivirus NS3 RNA helicase enzyme:

Du Pont, Kelly E. ; McCullagh, Martin ; Geiss, Brian J.
WIREs RNA.  13 (2021)  2 - p. , 2021
Link: https://doi.org/10.1002/..
 
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11

NMR and MD Simulations Reveal the Impact of the V23D Mutati..:

Mohanty, Smita ; Chaudhary, Bharat ; Zoetewey, David.
The FASEB Journal.  35 (2021)  S1 - p. , 2021
Link: https://doi.org/10.1096/..
 
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12

Implicit Solvation Using the Superposition Approximation (I..:

Lake, Peter T. ; Mattson, Max A. ; McCullagh, Martin
Journal of Chemical Theory and Computation.  17 (2021)  2 - p. 703-713 , 2021
Link: https://doi.org/10.1021/..
 
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13

Role of ATP in the RNA Translocation Mechanism of SARS-CoV-..:

Weber, Ryan ; McCullagh, Martin
The Journal of Physical Chemistry B.  125 (2021)  31 - p. 8787-8796 , 2021
Link: https://doi.org/10.1021/..
 
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14

NMR and MD simulations reveal the impact of the V23D mutati..:

Chaudhary, Bharat P ; Zoetewey, David L ; McCullagh, Martin J.
Glycobiology.  31 (2021)  7 - p. 838-850 , 2021
Link: https://doi.org/10.1093/..
 
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15

Motif V regulates energy transduction between the flaviviru..:

Du Pont, Kelly E. ; Davidson, Russell B. ; McCullagh, Martin.
Journal of Biological Chemistry.  295 (2020)  6 - p. 1551-1564 , 2020
Link: https://doi.org/10.1074/..
 
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