Raman spectra simulation of antiplatelet drug-platelet interaction using DFT

Raman spectra simulation of antiplatelet drug-platelet interaction using DFT

Abstract The paper reflects the results of molecular docking and mathematical DFT simulation for antiplatelet drugs and the target platelet receptor/ferment interaction in the limited area. The results of Raman spectra simulation are implemented and obtained from the interaction of the clopidogrel m...

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Bibliographic Details
Main Authors: Anna Kundalevich, Anastasia Kapitunova, Kirill Berezin, Andrey Zyubin, Ekaterina Moiseeva, Vladimir Rafalskiy, Ilia Samusev
Format: Article
Language:English
Published: Nature Portfolio 2024-01-01
Series:Scientific Reports
Online Access:https://doi.org/10.1038/s41598-024-51605-7

Internet

https://doi.org/10.1038/s41598-024-51605-7

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