APPLICATION OF ARTIFICIAL-INTELLIGENCE FOR CHEMICAL INFERENCE .41. COMPUTER-ASSISTED STRUCTURAL INTERPRETATION OF H-1-NMR - SPECTRAL DATA

被引：11

作者：

EGLI, H ^{[1
]}

SMITH, DH ^{[1
]}

DJERASSI, C ^{[1
]}

机构：

[1] STANFORD UNIV, DEPT CHEM, STANFORD, CA 94305 USA

来源：

HELVETICA CHIMICA ACTA | 1982年 / 65卷 / 06期

关键词：

D O I：

10.1002/hlca.19820650624

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

页码：1898 / 1920

页数：23

共 25 条

[1] STRUCTURAL INTERPRETATION OF PROTON MAGNETIC-RESONANCE SPECTRA BY COMPUTER - FIRST-ORDER SPECTRA [J].

BEECH, G ;

JONES, RT ;

MILLER, K .

ANALYTICAL CHEMISTRY, 1974, 46 (06) :714-718

[2] STUDY OF CH-13 COUPLING-CONSTANTS IN PENTOPYRANOSES AND SOME OF THEIR DERIVATIVES [J].

BOCK, K ;

PEDERSEN, C .

ACTA CHEMICA SCANDINAVICA SERIES B-ORGANIC CHEMISTRY AND BIOCHEMISTRY, 1975, B 29 (02) :258-264

[3] STUDY OF C-13H COUPLING-CONSTANTS IN HEXOPYRANOSES [J].

BOCK, K ;

PEDERSEN, C .

JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 2, 1974, (03) :293-299

[4]

BRUEGEL W, 1973, HDB NMR SPECTRAL PAR, V1

[5] APPLICATIONS OF ARTIFICIAL-INTELLIGENCE FOR CHEMICAL INFERENCE .37. GENOA - A COMPUTER-PROGRAM FOR STRUCTURE ELUCIDATION UTILIZING OVERLAPPING AND ALTERNATIVE SUBSTRUCTURES [J].

CARHART, RE ;

SMITH, DH ;

GRAY, NAB ;

NOURSE, JG ;

DJERASSI, C .

JOURNAL OF ORGANIC CHEMISTRY, 1981, 46 (08) :1708-1718

[6]

CRANDELL CW, J CHEM COMP SCI

[7]

CRIST BV, 1981, THESIS U NEVADA RENO

[8] STRUCTURAL ELUCIDATION OF ORGANIC COMPOUNDS BY COMPUTER-AIDED COMPARISON OF SPECTRAL DATA [J].

ERNI, F ;

CLERC, JT .

HELVETICA CHIMICA ACTA, 1972, 55 (02) :489-&

[9] COMPUTERIZED MASS-SPECTRUM PREDICTION AND RANKING [J].

GRAY, NAB ;

CARHART, RE ;

LAVANCHY, A ;

SMITH, DH ;

VARKONY, T ;

BUCHANAN, BG ;

WHITE, WC ;

CREARY, L .

ANALYTICAL CHEMISTRY, 1980, 52 (07) :1095-1102

[10] APPLICATIONS OF ARTIFICIAL-INTELLIGENCE FOR CHEMICAL INFERENCE .34. COMPUTER-ASSISTED STRUCTURAL INTERPRETATION OF C-13 SPECTRAL DATA [J].

GRAY, NAB ;

CRANDELL, CW ;

NOURSE, JG ;

SMITH, DH ;

DAGEFORDE, ML ;

DJERASSI, C .

JOURNAL OF ORGANIC CHEMISTRY, 1981, 46 (04) :703-715

← 1 2 3 →