SCOPUS 정보 검색 플랫폼

Journal of the Chemical Society, Perkin Transactions 2

Volumn , Issue 3, 2002, Pages 478-483

Quantum topological molecular similarity. Part 4. A QSAR study of cell growth inhibitory properties of substituted (E)-1-phenylbut-1-en-3-ones

(2) O'Brien, Sean E a Popelier, Paul L A a

a UNIVERSITY OF NOTTINGHAM (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

AROMATIC COMPOUNDS; CARRIER CONCENTRATION; ELECTRONIC STRUCTURE; REGRESSION ANALYSIS; SUBSTITUTION REACTIONS;

BOND CRITICAL POINTS (BCP); WAVE FUNCTIONS;

QUANTUM THEORY;

EID: 0036006082 PISSN: 14701820 EISSN: None Source Type: Journal
DOI: None Document Type: Article

Times cited : (63)

References (57)

1
- 0003989038
- Chapman and Hall, London
- (1995) Molecular Similarity in Drug Design
- Dean, P.M.¹

2
- 67049111600
- ACS, Washington
- Exploring QSAR: Fundamentals and Applications in Chemistry and Biology, 1st edn. , vol.1
- Hansch, C.¹ Leo, A.²

3
- 0000070533
- ed. P. v. R. Schleyer, Chichester
- (1998) Quantitative Structure-Activity Relationships in Drug Design, Encyclopedia of Computational Chemistry , vol.3 , pp. 2309
- Kubinyi, H.¹

4
- 0000953575
- (1997) Chem. Rev. , vol.97 , pp. 2995
- Hansch, C.¹ Gao, H.²

5
- 0003476917
- ed. H. Kubinyi, ESCOM, Leiden
- (1993) 3D QSAR in Drug Design
- Cramer, R.D.¹ DePriest, S.A.² Patterson, D.E.³ Hecht, P.⁴

6
- 0000652554
- (1996) Chem. Rev. , vol.96 , pp. 1045
- Hansch, C.¹ Hoekman, D.² Gao, H.³

7
- 0035353656
- (2001) J. Chem. Inf. Comput. Sci. , vol.41 , pp. 764
- O'Brien, S.E.¹ Popelier, P.L.A.²

8
- 67049131032
- unpublished results
- (2001)
- Popelier, P.L.A.¹ Smith, P.² Chaudry, U.³ O'Brien, S.E.⁴

9
- 0004147938
- PhD Thesis, UMIST, Manchester
- (2000) Quantum Molecular Similarity, An Atoms in Molecules Approach
- O'Brien, S.E.¹

10
- 0000338194
- (1999) J. Phys. Chem. A , vol.103 , pp. 2883
- Popelier, P.L.A.¹

11
- 0004157499
- Oxford University Press
- (1990) Atoms in Molecules. A Quantum Theory
- Bader, R.F.W.¹

12
- 0003435922
- Pearson Education
- (2000) Atoms in Molecules. An Introduction
- Popelier, P.L.A.¹

13
- 0003989038
- ed. P. M. Dean, Chapman & Hall, London
- (1995) Molecular Similarity in Drug Design , pp. 215
- Popelier, P.L.A.¹

14
- 0034731603
- (2000) Chemom. Intell. Lab. Syst. , vol.54 , pp. 75
- Alsberg, B.K.¹ Marchand-Geneste, N.² King, R.D.³

15
- 10644250257
- (1964) Phys. Rev. B , vol.136 , pp. 864
- Hohenberg, P.¹ Kohn, W.²

16
- 0003560924
- Kluwer, Dordrecht
- (1990) Energy Density Functional Theory of Many-Electron Systems
- Kryachko, E.S.¹ Ludena, E.V.²

17
- 0003569570
- Oxford University Press, Oxford
- (1989) Density-Functional Theory of Atoms and Molecules
- Parr, R.G.¹ Yang, W.²

18
- 0003838469
- Wiley-VCH, Weinheim
- (2000) A Chemist's Guide to Density Functional Theory
- Koch, W.¹ Holthausen, M.C.²

19
- 0002425012
- (1995) Top. Curr. Chem. , vol.173 , pp. 85
- Allan, N.L.¹ Cooper, D.L.²

20
- 0002481393
- (1995) Top. Curr. Chem. , vol.174 , pp. 73
- Artymiuk, P.J.¹ Poirrette, A.R.² Rice, D.W.³ Willett, P.⁴

21
- 0002375313
- (1995) Top. Curr. Chem. , vol.173 , pp. 31
- Besalu, E.¹ Carbo, R.² Mestres, J.³ Sola, M.⁴

22
- 0003072233
- (1995) Top. Curr. Chem. , vol.173 , pp. 63
- Mezey, P.G.¹

23
- 0002739078
- (1995) Top. Curr. Chem. , vol.174 , pp. 27
- Mishra, P.C.¹ Kumar, A.²

24
- 0001786729
- (1995) Top. Curr. Chem. , vol.174 , pp. 1
- Ponec, R.¹

25
- 0002104477
- (1995) Top. Curr. Chem. , vol.173 , pp. 1
- Rouvray, D.H.¹

26
- 0000135628
- (1995) Top. Curr. Chem. , vol.174 , pp. 105
- Takahashi, Y.¹

27
- 0002597240
- (1995) Top. Curr. Chem. , vol.174 , pp. 45
- Tasi, G.¹ Palinko, I.²

28
- 0343986486
- (1999) J. Med. Chem. , vol.42 , pp. 5169
- Amat, L.¹ Carbó-Dorca, R.² Ponec, R.³

29
- 84962473660
- (1999) J. Comput.-Aided Mol. Des. , vol.13 , pp. 259
- Ponec, R.¹ Amat, L.² Carbó-Dorca, R.³

30
- 84962426077
- (1998) J. Comput. Chem. , vol.19 , pp. 1575
- Amat, L.¹ Carbó-Dorca, R.² Ponec, R.³

31
- 84962406699
- (1999) J. Phys. Org. Chem. , vol.12 , pp. 447
- Ponec, R.¹ Amat, L.² Carbó-Dorca, R.³

32
- 0003490549
- Springer, Berlin
- (2000) Molecular Similarity in QSAR and Drug Design, Lecture Notes , vol.73
- Carbó-Dorca, R.¹ Robert, D.² Amat, L.³ Girones, X.⁴ Besalu, E.⁵

33
- 0031455796
- (1997) Bioorg. Med. Chem. Lett. , vol.7 , pp. 3091
- Ducki, S.¹ Hadfield, J.A.² Hepworth, L.A.³ Lawrence, N.J.⁴ Liu, C.Y.⁵ McGown, A.T.⁶

34
- 33745145494
- (1994) Angew. Chem., Int. Ed. Engl. , vol.33 , pp. 620
- Bader, R.F.W.¹ Popelier, P.L.A.² Keith, T.A.³

35
- 0004201016
- Oxford University Press, New York
- (2001) Chemical Bonding and Molecular Geometry from Lewis to Electron Densities
- Gillespie, R.J.¹ Popelier, P.L.A.²

36
- 0001114780
- ed. A. Hinchliffe
- (2000) Atoms in Molecules, Spec. Publ. R. Soc. Chem. , vol.1 , pp. 143
- Popelier, P.L.A.¹ Aicken, F.M.² O'Brien, S.E.³

37
- 0347858842
- (1984) J. Am. Chem. Soc. , vol.106 , pp. 1594
- Bader, R.F.W.¹ MacDougall, P.J.² Lau, C.D.H.³

38
- 0020793405
- (1983) J. Am. Chem. Soc. , vol.105 , pp. 5061
- Bader, R.F.W.¹ Slee, T.S.² Cremer, D.³ Kraka, E.⁴

39
- 84995186640
- (1969) Int. J. Quantum Chem. , vol.3 , pp. 327
- Bader, R.F.W.¹ Preston, H.J.T.²

40
- 0033304713
- (1999) Can. J. Chem. , vol.77 , pp. 28
- O'Brien, S.E.¹ Popelier, P.L.A.²

41
- 67049123644
- P. L. A. Popelier, in MORPHY98, MORPHY98 - a program written by P. L. A. Popelier with a contribution from R. G. A. Bone, UMIST, Manchester, England, 1998

42
- 0001352517
- (1994) Chem. Phys. Lett. , vol.228 , pp. 160
- Popelier, P.L.A.¹

43
- 0004069563
- ed. P. von Ragué Schleyer, New York
- (1998) Partial Least Squares Projections to Latent Structures (PLS) in Chemistry
- Wold, S.¹ Sjostrom, M.² Eriksson, L.³

44
- 0003662455
- (1998) SIMCA-P 8.0

45
- 0004126072
- (1999) SIMCA-P 8.0 User Guide Tutorial

46
- 0003840821
- Oxford University Press
- (1995) Data Analysis for Chemists
- Livingstone, L.¹

47
- 0004120006
- (2000) SPSS Inc., version 10.0.7

48
- 0004214061
- Claremont California
- (1995) CLogP Windows version 2.0

49
- 0003422992
- Gaussian Inc.
- (1996) Exploring Chemistry with Electronic Structure Methods
- Foresman, J.B.¹ Frisch, A.²

50
- 0000189651
- (1993) J. Chem. Phys. , vol.98 , pp. 5648
- Becke, A.D.¹

51
- 0004133516
- M. J. Frisch, G. W. Trucks, H. B. Schlegel, G. E. Scuseria, M. A. Robb, J. R. Cheeseman, V. G. Zakrzewski, J. A. Montgomery, Jr., R. E. Stratmann, J. C. Burant, S. Dapprich, J. M. Millam, A. D. Daniels, K. N. Kudin, M. C. Strain, O. Farkas, J. Tomasi, V. Barone, M. Cossi, R. Cammi, B. Mennucci, C. Pomelli, C. Adamo, S. Clifford, J. Ochterski, G. A. Petersson, P. Y. Ayala, Q. Cui, K. Morokuma, D. K. Malick, A. D. Rabuck, K. Raghavachari, J. B. Foresman, J. Cioslowski, J. V. Ortiz, A. G. Baboul, B. B. Stefanov, G. Liu, A. Liashenko, P. Piskorz, I. Komaromi, R. Gomperts, R. L. Martin, D. J. Fox, T. Keith, M. A. Al-Laham, C. Y. Peng, A. Nanayakkara, C. Gonzalez, M. Challacombe, P. M. W. Gill, B. Johnson, W. Chen, M. W. Wong, J. L. Andres, M. Head-Gordon, E. S. Replogle and J. A. Pople, Gaussian, Inc., Pittsburgh PA, USA
- (1998) Gaussian 98, Revision A.7

52
- 0000135030
- ed. P. v. R. Schleyer
- (1998) AM1, Encyclopedia of Computational Chemistry , vol.1 , pp. 11
- Holder, A.J.¹

53
- 11644266970
- (1955) J. Chem. Phys. , vol.23 , pp. 1833
- Mulliken, R.S.¹

54
- 0034087870
- (2000) Anti-Cancer Drug Des. , vol.15 , pp. 135
- Lawrence, N.J.¹ McGown, A.T.² Ducki, S.³ Hadfield, J.A.⁴

55
- 0030983089
- (1997) J. Nat. Prod. , vol.60 , pp. 252
- Beekman, A.C.¹ Woerdenbag, H.J.² Van Uden, W.³ Pras, N.⁴ Konings, A.W.T.⁵ Wikström, H.V.⁶ Schmidt, T.J.⁷

56
- 0000370030
- (1994) J. Phys. Chem. , vol.98 , pp. 1135
- Lee, C.¹ Smithline, S.²

57
- 84987144670
- (1986) Int. J. Quantum Chem. , vol.30 , pp. 763
- Bowen-Jenkins, P.E.¹ Richards, W.G.²

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.