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-...

Full description

Bibliographic Details
Main Authors: Tan, Lai Heng, Kwoh, Chee Keong, Mu, Yuguang
Other Authors: School of Computer Science and Engineering
Format: Journal Article
Language:English
Published: 2024
Subjects:
Online Access:https://hdl.handle.net/10356/179422