RESEARCHER PROFILE

Horacio Pérez‐Sánchez

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H

Universidad Católica de Murcia

Computational Drug Discovery MethodsProtein Structure and DynamicsCholinesterase and Neurodegenerative DiseasesParallel Computing and Optimization TechniquesMachine Learning in Materials Science

Horacio Pérez‐Sánchez works in Computational Drug Discovery Methods, Protein Structure and Dynamics, Cholinesterase and Neurodegenerative Diseases, Parallel Computing and Optimization Techniques, Machine Learning in Materials Science. Recorded institutional associations include Universidad Católica de Murcia.

330Publications
6,041Citations
38H-index

Inclusion identifies researchers whose recorded research contributions may inform their university’s understanding of its research community. It does not rank individual research quality or establish current employment.

Selected research works

Up to 100 highly cited works; DOI links open the original research. Counts reflect the collected record, not real-time citation totals.

  1. MCC950 closes the active conformation of NLRP3 to an inactive state

    2019 · 439 citations
  2. Neural network and deep-learning algorithms used in QSAR studies: merits and drawbacks

    2018 · 224 citations
  3. High-Throughput parallel blind Virtual Screening using BINDSURF

    2012 · 190 citations
  4. A Comprehensive Docking and MM/GBSA Rescoring Study of Ligand Recognition upon Binding Antithrombin

    2017 · 190 citations
  5. Managing, Analysing, and Integrating Big Data in Medical Bioinformatics: Open Problems and Future Perspectives

    2014 · 173 citations
  6. Automatic selection of molecular descriptors using random forest: Application to drug discovery

    2016 · 157 citations
  7. Application advances of deep learning methods for de novo drug design and molecular dynamics simulation

    2021 · 155 citations
  8. Structure-based discovery of clinically approved drugs as Zika virus NS2B-NS3 protease inhibitors that potently inhibit Zika virus infection in vitro and in vivo

    2017 · 128 citations
  9. Evaluation of the Anti-Diabetic Activity of Some Common Herbs and Spices: Providing New Insights with Inverse Virtual Screening

    2019 · 109 citations
  10. Deep neural network in QSAR studies using deep belief network

    2017 · 104 citations
  11. Cuminaldehyde as the Major Component of Cuminum cyminum , a Natural Aldehyde with Inhibitory Effect on Alpha‐Synuclein Fibrillation and Cytotoxicity

    2015 · 101 citations
  12. A Review of Ligand-Based Virtual Screening Web Tools and Screening Algorithms in Large Molecular Databases in the Age of Big Data

    2018 · 96 citations
  13. Effect of inclusion of hydroxycinnamic and chlorogenic acids from green coffee bean in β-cyclodextrin on their interactions with whey, egg white and soy protein isolates

    2014 · 88 citations
  14. Accelerating Big Data Analysis through LASSO-Random Forest Algorithm in QSAR Studies

    2021 · 77 citations
  15. Towards the Interpretability of Machine Learning Predictions for Medical Applications Targeting Personalised Therapies: A Cancer Case Survey

    2021 · 71 citations
  16. Chitosan as stabilizing agent for negatively charged nanoparticles

    2016 · 68 citations
  17. Selective in vitro and in silico butyrylcholinesterase inhibitory activity of diterpenes and rosmarinic acid isolated from Perovskia atriplicifolia Benth. and Salvia glutinosa L.

    2016 · 65 citations
  18. New arylated benzo[h]quinolines induce anti-cancer activity by oxidative stress-mediated DNA damage

    2016 · 64 citations
  19. New role of the antidepressant imipramine as a Fascin1 inhibitor in colorectal cancer cells

    2020 · 64 citations
  20. Structure guided design and binding analysis of EGFR inhibiting analogues of erlotinib and AEE788 using ensemble docking, molecular dynamics and MM-GBSA

    2016 · 60 citations
  21. Use of cyclodextrins to recover catechin and epicatechin from red grape pomace

    2016 · 57 citations
  22. Intermolecular Carbonyl–olefin Metathesis with Vinyl Ethers Catalyzed by Homogeneous and Solid Acids in Flow

    2019 · 57 citations
  23. Hepatoprotective activity of chrysin is mediated through TNF-α in chemically-induced acute liver damage: An in vivo study and molecular modeling

    2017 · 55 citations
  24. Hantzsch-Type Dihydropyridines and Biginelli-Type Tetra-hydropyrimidines: A Review of their Chemotherapeutic Activities

    2015 · 53 citations
  25. The FDA-Approved Antiviral Raltegravir Inhibits Fascin1-Dependent Invasion of Colorectal Tumor Cells In Vitro and In Vivo

    2021 · 52 citations

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