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Nunes-Alves, Ariane
366  Ergebnisse:
Personensuche X
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1

Characterization of the Bottlenecks and Pathways for Inhibi..:

Sohraby, Farzin ; Nunes-Alves, Ariane
Journal of Chemical Information and Modeling.  64 (2024)  10 - p. 4193-4203 , 2024
Link: https://doi.org/10.1021/..
 
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2

EDITORIAL: Chemical Compound Space Exploration by Multiscal..:

Gryn'ova, Ganna ; Bereau, Tristan ; Müller, Carolin...
Journal of Chemical Information and Modeling.  64 (2024)  15 - p. 5737-5738 , 2024
Link: https://doi.org/10.1021/..
 
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3

pH-dependence of the Plasmodium falciparum chloroquine resi..:

Berger, Fiona ; Gomez, Guillermo M. ; Sanchez, Cecilia P....
Nature Communications.  14 (2023)  1 - p. , 2023
Link: https://doi.org/10.1038/..
 
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4

Advances in computational methods for ligand binding kineti..:

Sohraby, Farzin ; Nunes-Alves, Ariane
Trends in Biochemical Sciences.  48 (2023)  5 - p. 437-449 , 2023
Link: https://doi.org/10.1016/..
 
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5

AlphaFold2 in Molecular Discovery:

Nunes-Alves, Ariane ; Merz, Kenneth
Journal of Chemical Information and Modeling.  63 (2023)  19 - p. 5947-5949 , 2023
Link: https://doi.org/10.1021/..
 
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6

The Non-phosphorylating Glyceraldehyde-3-Phosphate Dehydrog..:

Eisenberg, Philip ; Albert, Leon ; Teuffel, Jonathan...
Frontiers in Microbiology.  13 (2022)  - p. , 2022
Link: https://doi.org/10.3389/..
 
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7

The (Re)-Evolution of Quantitative Structure–Activity Relat..:

Soares, Thereza A. ; Nunes-Alves, Ariane ; Mazzolari, Angelica...
Journal of Chemical Information and Modeling.  62 (2022)  22 - p. 5317-5320 , 2022
Link: https://doi.org/10.1021/..
 
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8

Diffusion of small molecule drugs is affected by surface in..:

Dey, Debabrata ; Nunes-Alves, Ariane ; Wade, Rebecca C..
iScience.  25 (2022)  10 - p. 105088 , 2022
Link: https://doi.org/10.1016/..
 
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9

Ligand unbinding mechanisms and kinetics for T4 lysozyme mu..:

Nunes-Alves, Ariane ; Kokh, Daria B. ; Wade, Rebecca C.
Current Research in Structural Biology.  3 (2021)  - p. 106-111 , 2021
Link: https://doi.org/10.1016/..
 
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10

Line-FRAP, A Versatile Method to Measure Diffusion Rates In..:

Dey, Debabrata ; Marciano, Shir ; Nunes-Alves, Ariane...
Journal of Molecular Biology.  433 (2021)  9 - p. 166898 , 2021
Link: https://doi.org/10.1016/..
 
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11

Prediction of the Drug–Target Binding Kinetics for Flexible..:

Nunes-Alves, Ariane ; Ormersbach, Fabian ; Wade, Rebecca C.
Journal of Chemical Information and Modeling.  61 (2021)  7 - p. 3708-3721 , 2021
Link: https://doi.org/10.1021/..
 
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12

Myotubularin-related protein 7 activates peroxisome prolife..:

Weidner, Philip ; Söhn, Michaela ; Schroeder, Torsten...
Oncogenesis.  9 (2020)  6 - p. , 2020
Link: https://doi.org/10.1038/..
 
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13

Impact of the Journal of Chemical Information and Modeling ..:

Mazzolari, Angelica ; Nunes-Alves, Ariane ; Wahab, Habibah A....
Journal of Chemical Information and Modeling.  60 (2020)  7 - p. 3328-3330 , 2020
Link: https://doi.org/10.1021/..
 
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14

Recent progress in molecular simulation methods for drug bi..:

Nunes-Alves, Ariane ; Kokh, Daria B ; Wade, Rebecca C
Current Opinion in Structural Biology.  64 (2020)  - p. 126-133 , 2020
Link: https://doi.org/10.1016/..
 
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15

Molecular Dynamics Simulations in Drug Discovery and Pharma..:

Salo-Ahen, Outi M. H. ; Alanko, Ida ; Bhadane, Rajendra...
Processes.  9 (2020)  1 - p. 71 , 2020
Link: https://doi.org/10.3390/..
 
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