药物设计
酪氨酸激酶
受体酪氨酸激酶
计算生物学
化学
信号转导
生物
药物发现
药物开发
细胞生物学
药理学
药品
合理设计
生物化学
遗传学
作者
Cheolhee Kim,Eunae Kim
标识
DOI:10.2174/0929867325666180622143548
摘要
Rational drug design is accomplished through the complementary use of structural biology and computational biology of biological macromolecules involved in disease pathology. Most of the known theoretical approaches for drug design are based on knowledge of the biological targets to which the drug binds. This approach can be used to design drug molecules that restore the balance of the signaling pathway by inhibiting or stimulating biological targets by molecular modeling procedures as well as by molecular dynamics simulations. Type III receptor tyrosine kinase affects most of the fundamental cellular processes including cell cycle, cell migration, cell metabolism, and survival, as well as cell proliferation and differentiation. Many inhibitors of successful rational drug design show that some computational techniques can be combined to achieve synergistic effects.
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