Aleix Gimeno

Tarragona, CT, Spain

Last Updated: 09/26/2026

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Found 14 publications

PDB-CAT: A user-friendly tool to classify and analyze PDB protein-ligand complexes.

PDB-CAT: A user-friendly tool to classify and analyze PDB protein-ligand complexes.

Journal: Protein science : a publication of the Protein Society

Published: July 02, 2025

Identification of N-Acyl Hydrazones as New Non-Zinc-Binding MMP-13 Inhibitors by Structure-Based Virtual Screening Studies and Chemical Optimization.

Identification of N-Acyl Hydrazones as New Non-Zinc-Binding MMP-13 Inhibitors by Structure-Based Virtual Screening Studies and Chemical Optimization.

Journal: International journal of molecular sciences

Published: May 18, 2023

Anti-Inflammatory and Immunomodulatory Effects of the Grifola frondosa Natural Compound o-Orsellinaldehyde on LPS-Challenged Murine Primary Glial Cells. Roles of NF-κβ and MAPK.

Anti-Inflammatory and Immunomodulatory Effects of the Grifola frondosa Natural Compound o-Orsellinaldehyde on LPS-Challenged Murine Primary Glial Cells. Roles of NF-κβ and MAPK.

Journal: Pharmaceutics

Published: April 20, 2021

Identification of Broad-Spectrum MMP Inhibitors by Virtual Screening.

Identification of Broad-Spectrum MMP Inhibitors by Virtual Screening.

Journal: Molecules (Basel, Switzerland)

Published: March 30, 2021

Haste makes waste: A critical review of docking-based virtual screening in drug repurposing for SARS-CoV-2 main protease (M-pro) inhibition.

Haste makes waste: A critical review of docking-based virtual screening in drug repurposing for SARS-CoV-2 main protease (M-pro) inhibition.

Journal: Medicinal research reviews

Published: March 24, 2021

Bioactivity Profile Similarities to Expand the Repertoire of COVID-19 Drugs.

Bioactivity Profile Similarities to Expand the Repertoire of COVID-19 Drugs.

Journal: Journal of chemical information and modeling

Published: July 17, 2020

Prediction of Novel Inhibitors of the Main Protease (M-pro) of SARS-CoV-2 through Consensus Docking and Drug Reposition.

Prediction of Novel Inhibitors of the Main Protease (M-pro) of SARS-CoV-2 through Consensus Docking and Drug Reposition.

Journal: International journal of molecular sciences

Published: April 14, 2020

Mining large databases to find new leads with low similarity to known actives: application to find new DPP-IV inhibitors.

Mining large databases to find new leads with low similarity to known actives: application to find new DPP-IV inhibitors.

Journal: Future medicinal chemistry

Published: July 13, 2019

The Light and Dark Sides of Virtual Screening: What Is There to Know?

The Light and Dark Sides of Virtual Screening: What Is There to Know?

Journal: International journal of molecular sciences

Published: December 30, 2018

Understanding the variability of the S1' pocket to improve matrix metalloproteinase inhibitor selectivity profiles.

Understanding the variability of the S1' pocket to improve matrix metalloproteinase inhibitor selectivity profiles.

Journal: Drug discovery today

Published: November 28, 2018

Anti-inflammatory and Proapoptotic Properties of the Natural Compound o-Orsellinaldehyde.

Anti-inflammatory and Proapoptotic Properties of the Natural Compound o-Orsellinaldehyde.

Journal: Journal of agricultural and food chemistry

Published: October 02, 2018

Combined Ligand- and Receptor-Based Virtual Screening Methodology to Identify Structurally Diverse Protein Tyrosine Phosphatase 1B Inhibitors.

Combined Ligand- and Receptor-Based Virtual Screening Methodology to Identify Structurally Diverse Protein Tyrosine Phosphatase 1B Inhibitors.

Journal: ChemMedChem

Published: April 23, 2018

Showing 1-12 of 14

Last Updated: 09/26/2026