Synthesis Analysis and Computer-Assisted Synthesis Planning.

被引:0
|
作者
Nevalainen, Vesa [1 ]
Pohjala, Esko [1 ]
Vaisanen, Sirkka [1 ]
机构
[1] Joensuun Yliopisto, Joensuu, Finl, Joensuun Yliopisto, Joensuu, Finl
来源
Kemia-Kemi/Finnish Chemical Journal | 1984年 / 11卷 / 03期
关键词
COMPUTER SOFTWARE - ORGANIC COMPOUNDS - Synthesis;
D O I
暂无
中图分类号
学科分类号
摘要
Computer-assisted synthesis planning is becoming a very powerful tool in organic chemistry. Synthesis parameters and their relationships are not, however, easy to express in mathematical models. In this review article general principles of synthesis design and computerized planning strategies are described. The essentials only of the two best-known computer programs (LHASA and SECS) are featured. For further evaluation of the use of artificial intelligence in organic synthesis a comparison of current methods is presented in table form.
引用
收藏
页码:217 / 223
相关论文
共 50 条
  • [1] Automation and computer-assisted planning for chemical synthesis
    不详
    NATURE REVIEWS METHODS PRIMERS, 2021, 1 (01):
  • [2] Automation and computer-assisted planning for chemical synthesis
    Yuning Shen
    Julia E. Borowski
    Melissa A. Hardy
    Richmond Sarpong
    Abigail G. Doyle
    Tim Cernak
    Nature Reviews Methods Primers, 1
  • [3] Computer-assisted synthesis and reaction planning in combinatorial chemistry
    Gasteiger, J
    Pförtner, M
    Sitzmann, M
    Höllering, R
    Sacher, O
    Kostka, T
    Karg, N
    PERSPECTIVES IN DRUG DISCOVERY AND DESIGN, 2000, 20 (01) : 245 - 264
  • [4] COMPUTER-ASSISTED SYNTHESIS
    ZEFIROV, NS
    GORDEEVA, EV
    USPEKHI KHIMII, 1987, 56 (10) : 1753 - 1772
  • [5] COMPUTER-ASSISTED ANALYSIS IN ORGANIC-SYNTHESIS
    COREY, EJ
    LONG, AK
    RUBENSTEIN, SD
    SCIENCE, 1985, 228 (4698) : 408 - 418
  • [6] COMPUTER-ASSISTED KNOWLEDGE ACQUISITION-SYSTEM FOR SYNTHESIS PLANNING
    NAKAYAMA, T
    JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES, 1991, 31 (04): : 495 - 503
  • [7] COMPUTER-ASSISTED CHEMICAL SYNTHESIS
    KAUFMAN, G
    LAURENCO, C
    RECHERCHE, 1981, 12 (123): : 742 - 744
  • [8] COMPUTER ASSISTED STRATEGIC PLANNING.
    Holloway, Clark
    Pearce II, John A.
    Long Range Planning, 1982, 15 (04): : 56 - 63
  • [9] COMPUTER-ASSISTED ANALYSIS OF COMPLEX ORGANIC MOLECULAR SYNTHESIS
    COREY, EJ
    CRAMER, RD
    HOWE, WJ
    PENSAK, DA
    WIPKE, WT
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 1971, (MAR-A): : 4 - &