Understanding the interaction mechanisms of active compounds extracted from Tabernaemontana penduliflora on the surface of magnetite (111) nanoparticles in aqueous medium by DFT and MD approaches

Autor: Kamgang-Djioko, Fredy Harcel a, b, ⁎, Azambou, Christelle Ivane a, c, Tiomo, Lucresse Kora Nguena a, c, Nwanonenyi, Simeon Chukwudozie a, d, Kamgang Youbi, Georges b, Madu, Chinyere Ada a, Oguzie, Emeka Emmanuel a
Zdroj: In Journal of Molecular Graphics and Modelling March 2025 135
Databáze: ScienceDirect
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