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Graph Neural Networks as a Potential Tool in Improving Virtual Screening Programs
Despite the increasing number of pharmaceutical companies, university laboratories and funding, less than one percent of initially researched drugs enter the commercial market. In this context, virtual screening (VS) has gained much attention due to several advantages, including timesaving, reduced...
Autores principales: | , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Frontiers Media S.A.
2022
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8811035/ https://www.ncbi.nlm.nih.gov/pubmed/35127645 http://dx.doi.org/10.3389/fchem.2021.787194 |