RmsdXNA: RMSD prediction of nucleic acid-ligand docking poses using machine-learning method
Small molecule drugs can be used to target nucleic acids (NA) to regulate biological processes. Computational modeling methods, such as molecular docking or scoring functions, are commonly employed to facilitate drug design. However, the accuracy of the scoring function in predicting the closest-to-...
Main Authors: | Tan, Lai Heng, Kwoh, Chee Keong, Mu, Yuguang |
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Other Authors: | School of Computer Science and Engineering |
Format: | Journal Article |
Language: | English |
Published: |
2024
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Subjects: | |
Online Access: | https://hdl.handle.net/10356/179422 |
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