DFT and dynamic simulations of OleuoPectin structures as a potential anticoagulant agent
Abstract Oleuropein, a biologically active compound with variable pharmacological properties, is poorly absorbed in the gut, causing gastrointestinal upset in sensitive individuals. Model molecules of Oleuropein, pectin, and some proposed interactions were built up and geometrically optimized via bo...
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| Main Authors: | , , , , |
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| Format: | Article |
| Language: | English |
| Published: |
Nature Portfolio
2025-06-01
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| Series: | Scientific Reports |
| Subjects: | |
| Online Access: | https://doi.org/10.1038/s41598-025-06000-1 |
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