Advancements and novel approaches in modified AutoDock Vina algorithms for enhanced molecular docking
2024 · Results in Chemistry · 54 citations
https://doi.org/10.1016/j.rechem.2024.101319
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Simona Concilio
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Simona Concilio is an academic researcher from University of Salerno. The author has contributed to research in topics: Crystallization and Solubility Studies & X-ray Diffraction in Crystallography & Organic Electronics and Photovoltaics. The author has an h-index of 31, co-authored 136 publications.
ORCID: 0000-0002-1461-9301Papers by this author
worksCheminformatics in advancing dengue antiviral research: From conventional molecular modeling (MM) to current artificial intelligence (AI) approaches
2025 · European Journal of Medicinal Chemistry Reports · 2 citations
https://doi.org/10.1016/j.ejmcr.2025.100295
A battleship between hydroxamates versus non-hydroxamates: Exploring semi-empirical quantum properties, chemical space network, activity landscape, scaffold diversity of HDAC3 inhibitors to improve memory and learning
2025 · Journal of Molecular Graphics and Modelling · 0 citations
https://doi.org/10.1016/j.jmgm.2025.109199
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