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Defelipe, Lucas A.
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1

Solvent Sites Improve Docking Performance of Protein–Protei..:

Mayol, Gonzalo F. ; Defelipe, Lucas A. ; Arcon, Juan Pablo..
Journal of Chemical Information and Modeling.  62 (2022)  15 - p. 3577-3588 , 2022
Link: https://doi.org/10.1021/..
 
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2

Cosolvent Sites-Based Discovery of Mycobacterium Tuberculos..:

Burastero, Osvaldo ; Defelipe, Lucas A. ; Gola, Gabriel...
Journal of Medicinal Chemistry.  65 (2022)  14 - p. 9691-9705 , 2022
Link: https://doi.org/10.1021/..
 
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3

Specificity and Reactivity of Mycobacterium tuberculosis Se..:

Burastero, Osvaldo ; Cabrera, Marisol ; Lopez, Elias D....
Journal of Chemical Information and Modeling.  62 (2022)  7 - p. 1723-1733 , 2022
Link: https://doi.org/10.1021/..
 
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4

Deamidation drives molecular aging of the SARS-CoV-2 spike ..:

Lorenzo, Ramiro ; Defelipe, Lucas A. ; Aliperti, Lucio...
Journal of Biological Chemistry.  297 (2021)  4 - p. 101175 , 2021
Link: https://doi.org/10.1016/..
 
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5

FoldAffinity: binding affinities from nDSF experiments:

Niebling, Stephan ; Burastero, Osvaldo ; Bürgi, Jérôme...
Scientific Reports.  11 (2021)  1 - p. , 2021
Link: https://doi.org/10.1038/..
 
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6

Six novel variants in the PKLR gene associated with pyruvat..:

Milanesio, Berenice ; Pepe, Carolina ; Defelipe, Lucas A....
Clinical Biochemistry.  91 (2021)  - p. 26-30 , 2021
Link: https://doi.org/10.1016/..
 
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7

Development of an Improved Guanidine‐Based Rac1 Inhibitor w..:

Ciarlantini, Matías S. ; Barquero, Andrea ; Bayo, Juan...
ChemMedChem.  16 (2021)  6 - p. 1011-1021 , 2021
Link: https://doi.org/10.1002/..
 
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8

eSPC: an online data-analysis platform for molecular biophy..:

Burastero, Osvaldo ; Niebling, Stephan ; Defelipe, Lucas A....
Acta Crystallographica Section D Structural Biology.  77 (2021)  10 - p. 1241-1250 , 2021
Link: https://doi.org/10.1107/..
 
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9

Aromatic clusters in protein–protein and protein–drug compl..:

Lanzarotti, Esteban ; Defelipe, Lucas A. ; Marti, Marcelo A..
Journal of Cheminformatics.  12 (2020)  1 - p. , 2020
Link: https://doi.org/10.1186/..
 
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10

New one-pot synthesis of anti-tuberculosis compounds inspir..:

Ghiano, Diego G. ; Recio-Balsells, Alejandro ; Bortolotti, Ana...
European Journal of Medicinal Chemistry.  208 (2020)  - p. 112699 , 2020
Link: https://doi.org/10.1016/..
 
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11

Conformational and Reaction Dynamic Coupling in Histidine K..:

Olivieri, Federico A. ; Burastero, Osvaldo ; Drusin, Salvador I....
Journal of Chemical Information and Modeling.  60 (2020)  2 - p. 833-842 , 2020
Link: https://doi.org/10.1021/..
 
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12

Cosolvent-Based Protein Pharmacophore for Ligand Enrichment..:

Arcon, Juan Pablo ; Defelipe, Lucas A. ; Lopez, Elias D....
Journal of Chemical Information and Modeling.  59 (2019)  8 - p. 3572-3583 , 2019
Link: https://doi.org/10.1021/..
 
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13

Reverse Engineering of an Aspirin-Responsive Transcriptiona..:

Monteiro, Lummy Maria Oliveira ; Arruda, Letı́cia Magalhães ; Sanches-Medeiros, Ananda...
ACS Synthetic Biology.  8 (2019)  8 - p. 1890-1900 , 2019
Link: https://doi.org/10.1021/..
 
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14

Kinase Activation by Small Conformational Changes:

Lopez, Elias D. ; Burastero, Osvaldo ; Arcon, Juan P....
Journal of Chemical Information and Modeling.  60 (2019)  2 - p. 821-832 , 2019
Link: https://doi.org/10.1021/..
 
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15

Folding and Dynamics Are Strongly pH-Dependent in a Psychro..:

González-Lebrero, Rodolfo M. ; Defelipe, Lucas ; Modenutti, Carlos...
The Journal of Physical Chemistry B.  123 (2019)  36 - p. 7676-7686 , 2019
Link: https://doi.org/10.1021/..
 
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