Application of graph theory: Prediction of cytosolic phospholipase A 2 inhibitory activity of propan-2-ones

Journal of Mathematical Chemistry

Volumn 39, Issue 3-4, 2006, Pages 511-521

  Kumar, Vipin ^a   Madan, A K ^a  

^a MAHARSHI DAYANAND UNIVERSITY   (India)

Author keywords

Cytosolic phospholipase A2 inhibitory activity; Eccentric connectivity index; Propan 2 ones; Wiener's index; Zagreb group parameter

Indexed keywords

EID: 33746877516     PISSN: 02599791     EISSN: None     Source Type: Journal    
DOI: 10.1007/s10910-005-9036-y     Document Type: Article

References (50)

1. S.C. Basak, G.J. Niemi and G.D. Veith, J. Math. Chem. 4 (1990) 185.
2. S. Sardana and A.K. Madan, MATCH Commun. Math. Comput. Chem. 45 (2002) 35.
3. S.C. Basak, S. Bertelsen and G. Grunwald, J. Chem. Inf. Comput. Sci. 34 (1994) 270.
4. R.E. Carhart, D.H. Smith and R. Venkataraghavan, J. Chem. Inf. Comput. Sci. 25 (1985) 64.
5. S.C. Basak, Med. Sci. Res. 15 (1987) 605.
6. S.C. Basak, D.K. Harriss and V.R. Magnuson, J. Pharm. Sci. 73 (1984) 429.
7. L.B. Kier and L.H. Hall, Molecular Connectivity in Structure-Activity Analysis (Research Studies Press, Letchworth, UK, 1986).
8. S.C. Basak and G.D. Grunwald, New J. Chem. 19 (1995) 231.
9. A.T. Balaban, J. Chem. Inf. Comput. Sci. 25 (1985) 334.
10. A.T. Balaban, I. Motoc, D. Bonchev and O. Mekenya, Top. Curr. Chem. 114 (1983) 21.
11. D. Bonchev, O. Mekenya and A.T. Balaban, in: Mathematical and Computational Concepts in Chemistry, eds. N. Trinajstic and E. Horwood (Chichester, England, 1986) pp. 34-37.
12. E. Estrada and A. Ramirez, J. Chem. Inf. Comput. Sci. 36 (1996) 837.
13. H. Hosoya, Bull. Chem. Soc. Jpn. 44(337) (1971) 2332.
14. H. Hosoya, J. Chem. Doc. 12 (1972) 181.
15. M. Randic, J. Am. Chem. Soc. 97 (1974) 6609.
16. G.W. Kauffman and P.C. Jurs, J. Chem. Inf. Comput. Sci. 41 (2001) 1553.
17. S. Gupta, M. Singh and A.K. Madan, J. Chem. Inf. Comput. Sci. 39 (1999) 272.
18. A.T. Balaban, A. Chiriac, I. Motoc and Z. Simon, Lect. Notes Chem. 15 (1980) 22.
19. A.T. Balaban and L.B. Quintas, J. Math. Chem. 14 (1983) 163.
20. H. Wiener, J. Chem. Phys. 15 (1974) 766.
21. M. Randic, X. Guo, T. Oxely and H. Krishnapriyan, J. Chem. Inf. Comput. Sci. 33 (1993) 709.
22. S. Sardana and A.K. Madan, J. Mol. Str. (THEOCHEM) 638 (2003) 41.
23. I. Gutman, B. Ruscic, N. Trinajstic and C.F. Wilcox, J. Chem. Phys. 62 (1975) 3399.
24. I. Gutman and M. Randic, Chem. Phys. Lett. 47 (1977) 15.
25. S. Gupta, M. Singh and A.K. Madan, J. Math. Anal. Applic. 266 (2002) 259.
26. S. Sardana and A.K. Madan, MATCH Commun. Math. Comput. Chem. 43 (2001) 85.
27. S. Sardana and A.K. Madan, J. Mol. Model. 8 (2002) 258.
28. V. Kumar and A.K. Madan, MATCH Commun. Math. Comput. Chem. 51 (2004) 59.
29. V. Sharma, R. Goswami and A.K. Madan, J. Chem. Inf. Comput. Sci. 37 (1997) 273.
30. S. Gupta, M. Singh and A.K. Madan, J. Comp. Aided Mol. Des. 15 (2001) 671.
31. A. Sabljic and N. Trinajstic, Acta Pharm. Jugsol. 31 (1981) 189.
32. D.H. Rouvray, J. Mol. Struct. (THEOCHEM) 185 (1989) 187.
33. J. Galvez, R. Garcia-Domenec, J.N. Dejulian-Ortiz and R. Soler, J. Chem. Inf. Comput. Sci. 35 (1995) 272.
34. A.J. Slotboom, H.M. Verheij and G.H. de Hass, in: Phospholipids, eds. J.N. Hawthorne and G.B. Ansell (Elsevier Biomedical Press, Amsterdam, 1982) pp. 359-434.
35. http://faculty.washington.edu/gelb/pla2.html
36. http://www.ampainsoc.org/abstract/2001/data/553/
37. W. Uhl, T.J. Nevalainen and M.W. Büchler, Phospholipase A 2: Basic and Clinical Aspects in Inflammatory Diseases (Karger, Basel, 1997).
38. D.J. Schrier, C.M. Flory, M. Finkel, S.L. Kuchera, M.E. Lesch and P.B. Jacobson, Arthritis Rheum. 39 (1996) 1292.
39. S. Connolly, C. Bennion, P.J. Croshaw, C. Hallam, K. Hardy, P. Hartopp, C.G. Jackson, S.J. King, L. Lawrence, A. Mete, D. Murray, D.H. Robinson, G.M. Smith, L. Stein, I. Walters, E. Wells and W.J. Withnall, J. Med. Chem. 45 (2002) 1348.
40. D. Bonchev and N. Trinajstic, J. Chem. Phys. 67 (1977) 4517.
41. C. Raychaudhury, S.K. Ray, J.J. Ghosh, A.B. Roy and S.C. Basak, J. Comput. Chem. 5 (1994) 581.
42. W. Fisanick, K.P. Cross and A. Rusinko III, J. Chem. Inf. Comput. Sci. 32 (1992) 664.
43. M. Randic, J. Chem. Inf. Comput. Sci. 24 (1984) 164.
44. S.C. Basak, S. Bertelsen and G.D. Grunwald, J. Chem. Inf. Comput. Sci. 34 (1994) 270.
45. R.E. Carhart, D.H. Smith and R. Venkataraghavan, J. Chem. Inf. Comput. Sci. 25 (1985) 64.
46. C.L. Wilkins and M. Randic, Theoretica. Chimica. Acta 58 (1980) 45.
47. S.C. Basak and G.D. Grunwald, Mathl. Modelling Sci. Comput. 2 (1993) 735.
48. G. Klopman and C. Raychaudhury, J. Comput. Chem. 9 (1988) 232.
49. A.A. Farooqui, W.Y. Ong and L.A. Horrocks, Curr. Drug Targets Cardiovascular & Haematol. Disorders. 4 (2004) 85.
50. G. Kokotos, D.A. Six, V. Loukas, T. Smith, V. Constantinou-Kokotou, D. Hadjipavlou-Litina, S. Kotsovolou, A. Chiou, C.C. Beltzner and E.A. Dennis, J. Med. Chem. 47 (2004) 3615.