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Morgenstern, Amanda
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1

Gradient Bundle Analysis of Electric Field Induced Changes ..:

Epperson, Logan ; Mascarenas, Megan ; Morgenstern, Amanda
The Journal of Physical Chemistry A.  127 (2023)  21 - p. 4682-4694 , 2023
Link: https://doi.org/10.1021/..
 
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2

Bond Bundle Analysis of Ketosteroid Isomerase:

Wilson, Timothy R. ; Morgenstern, Amanda ; Alexandrova, Anastassia N..
The Journal of Physical Chemistry B.  126 (2022)  46 - p. 9443-9456 , 2022
Link: https://doi.org/10.1021/..
 
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3

Computer-Assisted Design of Macrocyclic Chelators for Actin..:

Morgenstern, Amanda ; Lilley, Laura M. ; Stein, Benjamin W....
Inorganic Chemistry.  60 (2020)  2 - p. 623-632 , 2020
Link: https://doi.org/10.1021/..
 
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4

Development of Density Functional Tight-Binding Parameters ..:

Aguirre, Néstor F. ; Morgenstern, Amanda ; Cawkwell, M. J...
Journal of Chemical Theory and Computation.  16 (2020)  3 - p. 1469-1481 , 2020
Link: https://doi.org/10.1021/..
 
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5

Advancing Chelation Chemistry for Actinium and Other +3 f-E..:

Stein, Benjamin W. ; Morgenstern, Amanda ; Batista, Enrique R....
Journal of the American Chemical Society.  141 (2019)  49 - p. 19404-19414 , 2019
Link: https://doi.org/10.1021/..
 
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6

Charge density analysis attending bond torsion: A bond bund..:

Goss, Jordan ; Wilson, Tim ; Morgenstern, Amanda.
International Journal of Quantum Chemistry.  118 (2018)  24 - p. , 2018
Link: https://doi.org/10.1002/..
 
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7

Quantified electrostatic preorganization in enzymes using t..:

Morgenstern, Amanda ; Jaszai, Matthew ; Eberhart, Mark E..
Chemical Science.  8 (2017)  7 - p. 5010-5018 , 2017
Link: https://doi.org/10.1039/..
 
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8

Predicting Chemical Reactivity from the Charge Density thro..:

Morgenstern, Amanda ; Wilson, Timothy R. ; Eberhart, M. E.
The Journal of Physical Chemistry A.  121 (2017)  22 - p. 4341-4351 , 2017
Link: https://doi.org/10.1021/..
 
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9

Predictive methods for computational metalloenzyme redesign..:

Valdez, Crystal E. ; Morgenstern, Amanda ; Eberhart, Mark E..
Physical Chemistry Chemical Physics.  18 (2016)  46 - p. 31744-31756 , 2016
Link: https://doi.org/10.1039/..
 
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10

Histone Deacetylase 8: Characterization of Physiological Di..:

Nechay, Michael R. ; Gallup, Nathan M. ; Morgenstern, Amanda...
The Journal of Physical Chemistry B.  120 (2016)  26 - p. 5884-5895 , 2016
Link: https://doi.org/10.1021/..
 
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11

Bond dissociation energies from the topology of the charge ..:

Morgenstern, Amanda ; Eberhart, Mark
Physica Scripta.  91 (2016)  2 - p. 023012 , 2016
Link: https://doi.org/10.1088/..
 
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12

The influence of zero-flux surface motion on chemical react..:

Morgenstern, Amanda ; Morgenstern, Charles ; Miorelli, Jonathan..
Physical Chemistry Chemical Physics.  18 (2016)  7 - p. 5638-5646 , 2016
Link: https://doi.org/10.1039/..
 
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13

In search of an intrinsic chemical bond:

Morgenstern, Amanda ; Wilson, Tim ; Miorelli, Jonathan..
Computational and Theoretical Chemistry.  1053 (2015)  - p. 31-37 , 2015
Link: https://doi.org/10.1016/..
 
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14

Back Cover: A Full Topological Analysis of Unstable and Met..:

Miorelli, Jonathan ; Wilson, Tim ; Morgenstern, Amanda..
ChemPhysChem.  16 (2015)  1 - p. 260-260 , 2015
Link: https://doi.org/10.1002/..
 
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15

Molecular Design for Tuning Work Functions of Transparent C..:

Koldemir, Unsal ; Braid, Jennifer L. ; Morgenstern, Amanda...
The Journal of Physical Chemistry Letters.  6 (2015)  12 - p. 2269-2276 , 2015
Link: https://doi.org/10.1021/..
 
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