TB-IECS: an accurate machine learning-based scoring function for virtual screening

Machine learning-based scoring functions (MLSFs) have shown potential for improving virtual screening capabilities over classical scoring functions (SFs). Due to the high computational cost in the process of feature generation, the numbers of descriptors used in MLSFs and the characterization of pro...

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Detalles Bibliográficos
Autores principales: Zhang, Xujun, Shen, Chao, Jiang, Dejun, Zhang, Jintu, Ye, Qing, Xu, Lei, Hou, Tingjun, Pan, Peichen, Kang, Yu
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer International Publishing 2023
Materias:
Research
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10320911/
https://www.ncbi.nlm.nih.gov/pubmed/37403155
http://dx.doi.org/10.1186/s13321-023-00731-x

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10320911/
https://www.ncbi.nlm.nih.gov/pubmed/37403155
http://dx.doi.org/10.1186/s13321-023-00731-x

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