Borrelli, Kenneth
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4

Structural basis for isoform-specific inhibition of human C..:

Lynch, Eric M. ; DiMattia, Michael A. ; Albanese, Steven...
Proceedings of the National Academy of Sciences.  118 (2021)  40 - p. , 2021
 
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6

Improving Protein-ligand Modeling into Cryo-EM Data and the..:

Borrelli, Kenneth
Microscopy and Microanalysis.  26 (2020)  S2 - p. 2298-2299 , 2020
 
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9

Testing Physical Models of Passive Membrane Permeation:

Leung, Siegfried S. F. ; Mijalkovic, Jona ; Borrelli, Kenneth.
Journal of Chemical Information and Modeling.  52 (2012)  6 - p. 1621-1636 , 2012
 
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10

Ligand Migration in the Truncated Hemoglobin-II from Mycoba..:

Guallar, Victor ; Lu, Changyuan ; Borrelli, Kenneth..
Journal of Biological Chemistry.  284 (2009)  5 - p. 3106-3116 , 2009
 
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11

Induced-Fit Docking Enables Accurate Free Energy Perturbati..:

Xu, Tianchuan ; Zhu, Kai ; Beautrait, Alexandre...
Journal of Chemical Theory and Computation.  18 (2022)  9 - p. 5710-5724 , 2022
 
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13

Reliable and Accurate Solution to the Induced Fit Docking P..:

Miller, Edward B. ; Murphy, Robert B. ; Sindhikara, Daniel...
Journal of Chemical Theory and Computation.  17 (2021)  4 - p. 2630-2639 , 2021
 
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15

Docking Covalent Inhibitors: A Parameter Free Approach To P..:

Zhu, Kai ; Borrelli, Kenneth W. ; Greenwood, Jeremy R....
Journal of Chemical Information and Modeling.  54 (2014)  7 - p. 1932-1940 , 2014
 
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