计算机辅助多肽设计
首发时间:2013-07-09
摘要:肽不仅是体内重要的生理活性物质,而且涵盖传统小分子药物所不具备的特点,如低的毒性和高的生物兼容性,因而成为近年来药物研发的热点。高效合理的肽分子设计为肽类药物开拓注入了新的活力。近年来,科学共同体开始尝试将计算机辅助研究手段并借助生物信息学方法和工具来理性指导生物活性肽的设计和发现。鉴于此,本文以"计算机辅助多肽设计"为主题对该领域目前研究状况和未来发展趋势加以综述。
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Computer-aided peptide design
Abstract:Peptides are traditionally recognized as an important kind of biologically active substance, which possess several attractive features compared to small-molecule drugs and protein therapeutics. Rational design of functional peptides and their analogs has recently received increasing interest in the chemical, biological and medical communities. Nowadays, bioinformatics is becoming a promising way to support the rational design and discovery of active peptides with desired biological functions. Here, we depoly a comprehensive review on the current and future states of computer-aided peptide design. Through this perspective we lay our emphasis on peptide design and discovery where the methods, strategies and protocols of computational approaches and tools are employed.
Keywords: computer-aided peptide design bioinformatics peptidic drug
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