Graph Signal Processing Approach to QSAR/QSPR Model Learning of Compounds
Quantitative relationship between the activity/property and the structure of compound is critical in chemical applications. To learn this quantitative relationship, hundreds of molecular descriptors have been designed to describe the structure, mainly based on the properties of vertices and edges of...
| Veröffentlicht in: | IEEE transactions on pattern analysis and machine intelligence. - 1979. - 44(2022), 4 vom: 09. Apr., Seite 1963-1973 |
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| Format: | Online-Aufsatz |
| Sprache: | English |
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2022
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| Zugriff auf das übergeordnete Werk: | IEEE transactions on pattern analysis and machine intelligence |
| Schlagworte: | Journal Article Research Support, Non-U.S. Gov't |
| Online verfügbar |
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