Ab Initio Study of Vinblastine-Tubulin Anticancer Complex
Yazarlar (1)
| Makale Türü |
Özgün Makale
(Uluslararası alan indekslerindeki dergilerde yayınlanan tam makale)
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| Dergi Adı | Biomacromolecular Journal | ||
| Dergi Tarandığı Indeksler | |||
| Makale Dili | İngilizce | Basım Tarihi | 07-2015 |
| Cilt / Sayı / Sayfa | 1 / 1 / 46–51 | DOI | – |
| Makale Linki | https://scholar.google.com/scholar?cluster=11043127018368512713&hl=en&oi=scholarr | ||
| UAK Araştırma Alanları |
Fen Bilimleri ve Matematik
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| Özet |
| Vinblastine is an important anticancer agent known to diminish microtubule assembly. Ab initio calculations are applied to examine the structural properties and different energies of vinblastine-tubulin complex in different dielectric constants and temperatures. The aims of this work are discovery the best optimized structure and thermodynamic properties of vinblastine-tubulin complex and comparing the structure of the complex under in and out of in vivo conditions. Discovery dipole moment, frequency and intensity of vibration of the vinblastine-tubulin complex in different dielectric constants, finding free energy, enthalpy and entropy in different media that have been prepared in this paper could be useful in undrestanding the structural and thermodynamic properties of the complex. Results show the structure is more stable in water than the other media. The dipole moment of the structure at dielectric constant of 24 … |
| Anahtar Kelimeler |
