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Author

Maria Rita Gulotta

Observed names: GULOTTA, Maria Rita, Gulotta, Maria Rita, M. R. Gulotta, Maria R. Gulotta
Institution: Ri.MED
Observed institutions: Ri.MED, University of Palermo
ORCID: 0000-0001-5032-4888
Observed ORCID: 0000-0001-5032-4888
OpenAlex ID: A5069898343
An overview of recent molecular dynamics applications as medicinal chemistry tools for the undruggable site challenge
2018 · Ugo Perricone, Maria Rita Gulotta, et al. · MedChemComm · 54
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Exploring the SARS-CoV-2 Proteome in the Search of Potential Inhibitors via Structure-Based Pharmacophore Modeling/Docking Approach
2020 · Giulia Culletta, Maria Rita Gulotta, et al. · Computation · 40
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In Silico Insights towards the Identification of NLRP3 Druggable Hot Spots
2019 · Nedra Mekni, Maria De Rosa, et al. · International Journal of Molecular Sciences · 27
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A community effort in SARS‐CoV‐2 drug discovery
2023 · Johannes Schimunek, Philipp Seidl, et al. · Molecular Informatics · 18
Galectin-9 and Interferon-Gamma Are Released by Natural Killer Cells upon Activation with Interferon-Alpha and Orchestrate the Suppression of Hepatitis C Virus Infection
2022 · Anna Paola Carreca, Massimiliano Gaetani, et al. · Viruses · 17
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KUALA: a machine learning-driven framework for kinase inhibitors repositioning
2022 · Giada De Simone, Davide Stefano Sardina, et al. · Scientific Reports · 14
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Targeting SARS‐CoV‐2 RBD Interface: a Supervised Computational Data‐Driven Approach to Identify Potential Modulators
2020 · Maria Rita Gulotta, Jessica Lombino, et al. · ChemMedChem · 9
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A Computer-Based Methodology to Design Non-Standard Peptides Potentially Able to Prevent HOX-PBX1-Associated Cancer Diseases
2021 · Maria Rita Gulotta, Giada De Simone, et al. · International Journal of Molecular Sciences · 6
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Unveiling molecular moieties through hierarchical Grad-CAM graph explainability
2025 · Salvatore Contino, Paolo Sortino, et al. · BMC Bioinformatics · 5
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A Rational Design of α-Helix-Shaped Peptides Employing the Hydrogen-Bond Surrogate Approach: A Modulation Strategy for Ras-RasGRF1 Interaction in Neuropsychiatric Disorders
2021 · Maria Rita Gulotta, Riccardo Brambilla, et al. · Pharmaceuticals · 5
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ENO1/Hsp70 Interaction Domains: In Silico and In Vitro Insight for a Putative Therapeutic Target in Cancer
2025 · Maria Rita Gulotta, Ugo Perricone, et al. · ACS Omega · 4
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In-silico guided chemical exploration of KDM4A fragments hits
2023 · Jessica Lombino, Rosario Vallone, et al. · Clinical Epigenetics · 2
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Exploring Molecular Contacts of MUC1 at CIN85 Binding Interface to Address Future Drug Design Efforts
2021 · Maria Rita Gulotta, Serena Vittorio, et al. · International Journal of Molecular Sciences · 2
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JEDI Billion Molecules against Covid-19: compounds synthesized
2021 · Le, Tuan, Hempel, Tim, et al. · Figshare · 2
Dynamic‐shared Pharmacophore Approach as Tool to Design New Allosteric PRC2 Inhibitors, Targeting EED Binding Pocket
2020 · Jessica Lombino, Maria Rita Gulotta, et al. · Molecular Informatics · 1
Benchmarking descriptor-based AI approaches for predicting the BBB permeability of drug-like xenobiotics
2026 · Nicolina Sciaraffa, Martina Valentino, et al. · Journal of Cheminformatics
Novel indole-based derivatives as promising NLRP3 inflammasome inhibitors: Design, synthesis, biological evaluation, and in silico studies
2026 · Simona Di Martino, Maria Rita Giuffrè, et al. · European Journal of Pharmaceutical Sciences
In silico-guided exploration of SIRT6 modulation: Discovery of new fragments hits inhibitors
2025 · Ignazio Sardo, Giulia Culletta, et al. · Journal of Molecular Graphics and Modelling
KUALA: A Machine Learning-driven framework for kinase inhibitors repositioning
2022 · De Simone, Giada, Sardina, Davide Stefano, et al. · Zenodo (CERN European Organization for Nuclear Research)
Works count: 25
Citation count: 207
H-index: 7
I10-index: 6
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