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Boittier, Eric D.
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1

Systematic improvement of empirical energy functions in the..:

Devereux, Mike ; Boittier, Eric D. ; Meuwly, Markus
Journal of Computational Chemistry.  45 (2024)  22 - p. 1899-1913 , 2024
Link: https://doi.org/10.1002/..
 
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2

Structural investigation of CDCA3‐Cdh1 protein–protein inte..:

Barbhuiya, Tabassum Khair ; Fisher, Mark ; Boittier, Eric D....
Protein Science.  32 (2023)  3 - p. , 2023
Link: https://doi.org/10.1002/..
 
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3

Interaction at a distance: Xenon migration in Mb:

Turan, Haydar Taylan ; Boittier, Eric ; Meuwly, Markus
The Journal of Chemical Physics.  158 (2023)  12 - p. , 2023
Link: https://doi.org/10.1063/..
 
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4

The first HyDRA challenge for computational vibrational spe..:

Fischer, Taija L. ; Bödecker, Margarethe ; Schweer, Sophie M....
Physical Chemistry Chemical Physics.  25 (2023)  33 - p. 22089-22102 , 2023
Link: https://doi.org/10.1039/..
 
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5

Molecular Dynamics with Conformationally Dependent, Distrib..:

Boittier, Eric D. ; Devereux, Mike ; Meuwly, Markus
Journal of Chemical Theory and Computation.  18 (2022)  12 - p. 7544-7554 , 2022
Link: https://doi.org/10.1021/..
 
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6

Uncertainty quantification for predictions of atomistic neu..:

Vazquez-Salazar, Luis Itza ; Boittier, Eric D. ; Meuwly, Markus
Chemical Science.  13 (2022)  44 - p. 13068-13084 , 2022
Link: https://doi.org/10.1039/..
 
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7

Elevating CDCA3 levels in non-small cell lung cancer enhanc..:

Kildey, Katrina ; Gandhi, Neha S. ; Sahin, Katherine B....
Communications Biology.  4 (2021)  1 - p. , 2021
Link: https://doi.org/10.1038/..
 
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8

Transfer Learning to CCSD(T): Accurate Anharmonic Frequenci..:

Käser, Silvan ; Boittier, Eric D. ; Upadhyay, Meenu.
Journal of Chemical Theory and Computation.  17 (2021)  6 - p. 3687-3699 , 2021
Link: https://doi.org/10.1021/..
 
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9

Identification of Proteins Deregulated by Platinum-Based Ch..:

Ryan, Sarah-Louise ; Dave, Keyur A. ; Beard, Sam...
Frontiers in Oncology.  11 (2021)  - p. , 2021
Link: https://doi.org/10.3389/..
 
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10

Impact of the Characteristics of Quantum Chemical Databases..:

Vazquez-Salazar, Luis Itza ; Boittier, Eric D. ; Unke, Oliver T..
Journal of Chemical Theory and Computation.  17 (2021)  8 - p. 4769-4785 , 2021
Link: https://doi.org/10.1021/..
 
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11

Assessing Molecular Docking Tools to Guide Targeted Drug Di..:

Boittier, Eric D. ; Tang, Yat Yin ; Buckley, McKenna E....
International Journal of Molecular Sciences.  21 (2020)  15 - p. 5183 , 2020
Link: https://doi.org/10.3390/..
 
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12

GlycoTorch Vina: Docking Designed and Tested for Glycosamin..:

Boittier, Eric D. ; Burns, Jed M. ; Gandhi, Neha S..
Journal of Chemical Information and Modeling.  60 (2020)  12 - p. 6328-6343 , 2020
Link: https://doi.org/10.1021/..
 
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13

Cross-Species Analysis of Glycosaminoglycan Binding Protein..:

Boittier, Eric D. ; Gandhi, Neha S. ; Ferro, Vito.
Molecules.  24 (2019)  5 - p. 924 , 2019
Link: https://doi.org/10.3390/..
 
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14

Pathway Bifurcation in the (4 + 3)/(5 + 2)-Cycloaddition of..:

Burns, Jed M. ; Boittier, Eric D.
The Journal of Organic Chemistry.  84 (2019)  10 - p. 5997-6005 , 2019
Link: https://doi.org/10.1021/..
 
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15

Systematic Improvement of Empirical Energy Functions in the..:

Devereux, Mike ; Boittier, Eric D ; Meuwly, Markus
http://arxiv.org/abs/2310.18655.  , 2023
Link: http://arxiv.org/abs/231..
 
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