Molecular similarity searching based on deep learning for feature reduction

Molecular similarity searching based on deep learning for feature reduction

The concept of molecular similarity has been widely used in rational drug design, where structurally similar molecules are explored in molecular databases for retrieving functionally similar molecules. The most used conventional similarity methods are two-dimensional (2D) fingerprints to evaluate th...

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书目详细资料
主要作者:	Saeed Nasser, Maged Mohammed
格式:	Thesis
语言:	English
出版:	2022
主题:	QA75 Electronic computers Computer science
在线阅读:	http://eprints.utm.my/id/eprint/101478/1/MagedMohammedSaeedNasserPSC2022.pdf.pdf
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