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pro vyhledávání: '"Jonatan I. Sánchez S."'
Autor:
Dolores García-Toral, Raúl Mendoza Báez, Jonatan I. Sánchez S, Antonio Flores-Riveros, Gregorio H. Cocoletzi, J. F. Rivas-Silva
Publikováno v:
ACS Omega, Vol 6, Iss 23, Pp 14824-14837 (2021)
Externí odkaz:
https://doaj.org/article/0e33b9485e264f0989ce9ccabeb8ddc9
Publikováno v:
Theoretical Chemistry Accounts. 139
We study the encapsulation of anticancer drug, where a Carboplatin molecule gets inside a BN nanotube (14,0), via DFT and semiempirical method PM7-based calculations. In particular, we analyze the multipolar electric and non-covalent interactions amo