Persistent spectral-based machine learning (PerSpect ML) for protein-ligand binding affinity prediction
Molecular descriptors are essential to not only quantitative structure-activity relationship (QSAR) models but also machine learning–based material, chemical, and biological data analysis. Here, we propose persistent spectral–based machine learning (PerSpect ML) models for drug design. Different fro...
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| Main Authors: | , |
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| 格式: | Article |
| 語言: | English |
| 出版: |
2021
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| 在線閱讀: | https://hdl.handle.net/10356/151043 |
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