Výsledky vyhledávání - "Bahareh Naderizadeh"

Akademický článek

Nature of Metal–Drug Bond in Some Antitumor Active Complexes of Coinage Metal Ions

Publikováno v: ACS Omega, Vol 5, Iss 42, Pp 26999-27015 (2020)

Externí odkaz: https://doaj.org/article/e4ecd0a0da9d472f87eacf779bece13a

Nature of metal–NHC bonds in some potential anticancer [(NHC(R))2→M]+ (M = CuI, AgI, AuI, R =n-propyl, n-butyl, n-pentyl, n-hexyl, n-heptyl, n-octyl, n-nonyl, n-decyl) complexes

Autor: Mehdi Bayat, Bahareh Naderizadeh

Publikováno v: Mendeleev Communications. 31:179-181

A theoretical study of the structures and nature of the M←C bonds in NHC CuI, AgI and AuI cation complexes with two N,N′-dialkylbenzimidazolin-2-ylidene ligands was performed using natural bond orbital (NBO), atoms in molecules (AIM), energy deco

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_________::48e379eb3716e4e2bde6d7e18aa86502
https://doi.org/10.1016/j.mencom.2021.03.011

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Towards computational prediction of anti-cancer activity: Making connection between IC50 values and metal–ligand interaction energies in some NHC complexes of groups 10 and 11

Autor: Mehdi Bayat, Mohammad Ranjbaran, Bahareh Naderizadeh, Sadegh Salehzadeh

Publikováno v: Journal of Molecular Liquids. 341:117310

Finding a logical relation between the IC50 values of anticancer drugs and a computationally calculated physical quantity of them can be very useful in predicting and designing new drugs, reduces the time and cost and helps the society. In this work,

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_________::b76e26a777c6e149bdef1a91b0631612
https://doi.org/10.1016/j.molliq.2021.117310

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