Drug–target binding affinity prediction model based on multi-scale diffusion and interactive learning
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Published:2024-12
Issue:
Volume:255
Page:124647
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ISSN:0957-4174
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Container-title:Expert Systems with Applications
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language:en
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Short-container-title:Expert Systems with Applications
Author:
Zhu Zhiqin,
Zheng Xin,
Qi GuanqiuORCID,
Gong Yifei,
Li Yuanyuan,
Mazur NealORCID,
Cong Baisen,
Gao XinboORCID
Reference43 articles.
1. DeepCDA: deep cross-domain compound–protein affinity prediction through LSTM and convolutional neural networks;Abbasi;Bioinformatics,2020
2. Akiba, T., Sano, S., Yanase, T., Ohta, T., & Koyama, M. (2019). Optuna: A next-generation hyperparameter optimization framework. In Proceedings of the 25th ACM SIGKDD international conference on knowledge discovery & data mining (pp. 2623–2631).
3. An expert system rulebase for identifying contact allergens;Barratt;Toxicology in Vitro,1994
4. An open source chemical structure curation pipeline using RDKit;Bento;Journal of Cheminformatics,2020
5. Comprehensive analysis of kinase inhibitor selectivity;Davis;Nature Biotechnology,2011