Search Page
Save citations to file
Email citations
Send citations to clipboard
Add to Collections
Add to My Bibliography
Create a file for external citation management software
Your saved search
Your RSS Feed
Filters
Results by year
Table representation of search results timeline featuring number of search results per year.
Year | Number of Results |
---|---|
2018 | 1 |
2019 | 2 |
2020 | 1 |
2022 | 1 |
2023 | 1 |
2024 | 0 |
Search Results
6 results
Results by year
Filters applied: . Clear all
It looks like you are searching for an author.
Results are currently sorted by Best Match. To see the newest results first,
change the sort order to Most Recent.
Page 1
Testing Affordable Strategies for the Computational Study of Reactivity in Cysteine Proteases: The Case of SARS-CoV-2 3CL Protease Inhibition.
J Chem Theory Comput. 2022 Jun 14;18(6):4005-4013. doi: 10.1021/acs.jctc.2c00294. Epub 2022 May 13.
J Chem Theory Comput. 2022.
PMID: 35549334
Free PMC article.
LigRMSD: a web server for automatic structure matching and RMSD calculations among identical and similar compounds in protein-ligand docking.
Velázquez-Libera JL, Durán-Verdugo F, Valdés-Jiménez A, Núñez-Vivanco G, Caballero J.
Velázquez-Libera JL, et al.
Bioinformatics. 2020 May 1;36(9):2912-2914. doi: 10.1093/bioinformatics/btaa018.
Bioinformatics. 2020.
PMID: 31926012
Item in Clipboard
Computational study of the binding orientation and affinity of noncovalent inhibitors of the papain-like protease (PLpro) from SARS-CoV-1 considering the protein flexibility by using molecular dynamics and cross-docking.
Castillo-Campos L, Velázquez-Libera JL, Caballero J.
Castillo-Campos L, et al. Among authors: velazquez libera jl.
Front Mol Biosci. 2023 Jun 23;10:1215499. doi: 10.3389/fmolb.2023.1215499. eCollection 2023.
Front Mol Biosci. 2023.
PMID: 37426421
Free PMC article.
Item in Clipboard
Structural Requirements of N-alpha-Mercaptoacetyl Dipeptide (NAMdP) Inhibitors of Pseudomonas Aeruginosa Virulence Factor LasB: 3D-QSAR, Molecular Docking, and Interaction Fingerprint Studies.
Velázquez-Libera JL, Murillo-López JA, F de la Torre A, Caballero J.
Velázquez-Libera JL, et al.
Int J Mol Sci. 2019 Dec 5;20(24):6133. doi: 10.3390/ijms20246133.
Int J Mol Sci. 2019.
PMID: 31817391
Free PMC article.
Item in Clipboard
Insights into the Structural Requirements of 2(S)-Amino-6-Boronohexanoic Acid Derivatives as Arginase I Inhibitors: 3D-QSAR, Docking, and Interaction Fingerprint Studies.
Velázquez-Libera JL, Navarro-Retamal C, Caballero J.
Velázquez-Libera JL, et al.
Int J Mol Sci. 2018 Sep 28;19(10):2956. doi: 10.3390/ijms19102956.
Int J Mol Sci. 2018.
PMID: 30274146
Free PMC article.
Item in Clipboard
Docking, Interaction Fingerprint, and Three-Dimensional Quantitative Structure-Activity Relationship (3D-QSAR) of Sigma1 Receptor Ligands, Analogs of the Neuroprotective Agent RC-33.
Velázquez-Libera JL, Rossino G, Navarro-Retamal C, Collina S, Caballero J.
Velázquez-Libera JL, et al.
Front Chem. 2019 Jul 11;7:496. doi: 10.3389/fchem.2019.00496. eCollection 2019.
Front Chem. 2019.
PMID: 31355187
Free PMC article.
Item in Clipboard
Cite
Cite