定量构动关系与药物分子设计
Quantitative structure pharmacokinetic relationship and drug molecular design
作者:周鲁
Author:
收稿日期: 年卷(期)页码:2005,(04):-334-336
期刊名称:华西药学杂志
Journal Name:WEST CHINA JOURNAL OF PHARMACEUTICAL SCIENCES
关键字:药物分子设计;定量构动关系;药物结构参数;人工神经网络
Key words:
基金项目:
中文摘要
阐述了定量构动关系的研究对于药物设计的重要性和必要性,介绍了表征药物分子的结构参数以及将药物结构参数与药动学参数进行关联的人工神经网络,综述了近年来国内外药物定量构动关系的研究进展。
参考文献
[1]徐娟,王林.计算机辅助药物设计中的QSPR,QSAR和QSMR研究[J].国外医学药学分册,2003,30(3):135
[2] Marie-odile F, Martin B, kannan K. Quantitative structure pharma-cokinetics relationship modeling [ J]. The Sci of the Total Envi,2001,274:125
[3] Agatononic-kustrin S,Beresford R. Basic concepts of artificial neu-ral networks modeling and its application in pharmaceutical research[J]. J Pharm Biomed Anal,2000,22(5):717
[4]何勤,吴芳,蒋学华,等.药物动力学数据的神经网络处理方法[J].华西药学杂志,2002,17(2):123
[5] Gobburu JV, Shelver WH. Quantitative structure pharmacokineticsrelationship of beta blockers derived using neural networks [ J]. JPharm Sci,1995,84(7):862
[6] Ritschel WA,Akileswaran R,Hussain AS. Application of neural net-works for the predication of human pharmacokinetic parameters [J].Methods Find Exp Clin Parmacol,1995,17(9):629
[7] Opara J, Primozic S, Cvelbar P,et al.Prediction pharmacokineticparameters and the assessment of their variability in bioequivalencestudies by artificail neural networks [J].Pharma Res,1999,16(6):944
[8] Chen HY, Chen TC, Min DI,et al.The application of an artificailneural networks and pharmacokinetics simulations in the design of con-trolled-release dosage forms [J]. J Control Release,1999,59(1):25
[9] Karlen, Anders, Winiwarter.Correlation of intestinal drug permeabil-ity in humans( in vivo)with experimentally and theoretically derivedparameters [ C]. Mol Model Predict Bioact,12th, Meeting Date,1998.492
[10] Yoshida Fumitaka, Topliss, John G. QSAR model of drug human oralbioavailability[J]. J Med Chem,2000,43(13):2575
[11]周鲁,左之利,苏怡,等.药物生物利用度的定量构动关系研究[J].华西药学杂志,2003,18(2):81
[12]周鲁,苏怡,左之利,等.抗生素血浆蛋白结合率的定量构动关系研究[J].华西药学杂志,2003,18(1):1
[13]周鲁,赵蔡斌.药物清除率的定量构动关系研究[J].华西药学杂志,2005,20(1):4
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