Efficient Deep Model Ensemble Framework for Drug-Target Interaction Prediction

Accurate prediction of Drug-Target Interactions (DTI) is crucial for drug development. Current state-of-the-art deep learning methods have significantly advanced the field; however, these methods exhibit limitations in predictive performance and the propensity for false negatives. Therefore, we prop...

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Veröffentlicht in:	The journal of physical chemistry letters 2024-08, Vol.15 (30), p.7681-7693
Hauptverfasser:	Wei, Jinhang, Zhu, Yangbin, Zhuo, Linlin, Liu, Yang, Fu, Xiangzheng, Li, Fushan
Format:	Artikel
Sprache:	eng
Schlagworte:	Deep Learning Drug Discovery Humans NAD(P)H Dehydrogenase (Quinone) - metabolism Physical Insights into Materials and Molecular Properties Sirtuin 1 - metabolism
Online-Zugang:	Volltext
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