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日用化学工业 ›› 2019, Vol. 49 ›› Issue (4): 253-258.doi: 10.3969/j.issn.1001-1803.2019.04.010

• 专论与综述 • 上一篇    下一篇

计算机辅助药物设计用于化妆品植物源功效原料筛选的建议

赵斯琪1,2,孟宏1,2,易帆1,2()   

  1. 1. 北京工商大学 中国轻工业化妆品重点实验室,北京 100048
    2. 北京工商大学 北京市植物资源重点实验室,北京 100048
  • 收稿日期:2019-01-20 修回日期:2019-03-27 出版日期:2019-04-22 发布日期:2019-04-24
  • 通讯作者: 易帆
  • 作者简介:赵斯琪(1994-),女,吉林人,电话:18500037474,E-mail:zsq_5666@163.com。

Recommendation of computer-aided drug design for the screening of cosmetic plant source efficacy materials

ZHAO Si-qi1,2,MENG Hong1,2,YI Fan1,2()   

  1. 1. Key Laboratory of Cosmetics, China National Light Industry, Beijing Technology and Business University, Beijing 100048, China
    2. Beijing Key Laboratory of Plant Resources Research and Development, Beijing Technology and Business University, Beijing 100048, China
  • Received:2019-01-20 Revised:2019-03-27 Online:2019-04-22 Published:2019-04-24
  • Contact: Fan YI

摘要:

对计算机辅助药物设计技术应用于化妆品植物来源功效物质筛选和预测进行综述,论述其应用于预测药用植物所含成分在皮肤相关生物学途径中靶蛋白的结合关系,以及整体评价药用植物在皮肤生理学上的作用。提出构建完整、高效、便捷的原料研发模式的建议,并对其进行展望。

关键词: 化妆品功效原料, 虚拟筛选, 植物原料, 计算机辅助药物设计

Abstract:

The application of computer-aided drug design technology in the screening and prediction of functional substances in cosmetic plant materials was reviewed, its application in predicting the binding relationship of target proteins in skin-related biological pathways of medicinal plants, and the overall evaluation of the role of medicinal plants in skin physiology were discussed. Suggestions for constructing a complete, efficient and convenient raw material research and development model are proposed and prospected.

Key words: cosmetic efficacy raw materials, virtual screening, plant materials, computer-aided drug design

中图分类号: 

  • TQ658