Development and validation of an adjustment factor for the AutoDock4 scores of ACE inhibitors

Molecular docking is a powerful technique for simulating ligand-protein interactions and predicting how drugs interact with their targets. However, it often produces scores that do not correlate with experimental binding affinity. Thus, the researchers aimed to determine an ideal ligand preparation...

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Main Authors: Asia, Albert Thomas L. (Author), Bayle, Franco Angelo C. (Author)
מחברים אחרים: Dornagon, Rhoen Mae P. (author .), Padilla, Vince Lambert H. (adviser .)
פורמט: Thesis
שפה:English
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