Electronic structures of Ascaris trypsin inhibitor in solution

Physical Review E - Statistical Physics, Plasmas, Fluids, and Related Interdisciplinary Topics

Volumn 68, Issue 5, 2003, Pages

  Zheng, Haoping ^a  

^a TONGJI UNIVERSITY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

AMINO ACIDS; ANNEALING; ELECTRONIC STRUCTURE; ENZYME INHIBITION; GROUND STATE; MATHEMATICAL MODELS; NUCLEAR MAGNETIC RESONANCE; OXYGEN;

CHARGE DENSITY; FIBRINOLYSIS; NUCLEAR CHARGES;

PROTEINS;

ANIMAL; ASCARIS; BINDING SITE; CHEMICAL STRUCTURE; ELECTRON; IMAGE PROCESSING; METABOLISM; PROTEIN TERTIARY STRUCTURE; STATISTICAL MODEL;

ANIMALS; ASCARIS; BINDING SITES; ELECTRONS; IMAGE PROCESSING, COMPUTER-ASSISTED; MODELS, MOLECULAR; MODELS, STATISTICAL; PROTEIN STRUCTURE, TERTIARY;

EID: 84990954675     PISSN: 1063651X     EISSN: None     Source Type: Journal    
DOI: 10.1103/PhysRevE.68.051908     Document Type: Article

References (28)

1. G.P.M. Crawford, D.J. Howse, and D.I. Grove, J. Parasitol. 68, 1044 (1982).
2. W. Yang, Phys. Rev. Lett. 66, 1438 (1991);
3. W. YangPhys. Rev. A 44, 7823 (1991).
4. P. Cortona, Phys. Rev. B 44, 8454 (1991).
5. G. Galli and M. Parrinello, Phys. Rev. Lett. 69, 3547 (1992).
6. F. Mauri, G. Galli, and R. Car, Phys. Rev. B 47, 9973 (1993).
7. X.-P. Li, R.W. Nunes, and D. Vanderbilt, Phys. Rev. B 47, 10 891 (1993).
8. T.A. Wesolowski and A. Warshel, J. Phys. Chem. 97, 8050 (1993).
9. P. Ordejon, D.A. Drabold, R.M. Martin, and M.P. Grumbach, Phys. Rev. B 51, 1456 (1995).
10. W. Yang and Tai-sung Lee, J. Chem. Phys. 103, 5674 (1995).
11. W. Kohn, Phys. Rev. Lett. 76, 3168 (1996).
12. R. Baer and M. Head-Gordon, Phys. Rev. Lett. 79, 3962 (1997).
13. Haoping Zheng, Phys. Rev. B 48, 14868 (1993).
14. Haoping Zheng, Phys. Lett. A 226, 223 (1997);
15. Phys. Lett. AHaoping Zheng231, 453 (1997).
16. Haoping Zheng, Physica B 212, 125 (1995).
17. H. Zheng, B.K. Rao, S.N. Khanna, and P. Jena, Phys. Rev. B 55, 4174 (1997).
18. H. Zheng, Y. Wang, and G. Ma, Eur. Phys. J. B 29, 61 (2002).
19. J. He and H. Zheng, Acta Phys. Sin. 51, 2580 (2002).
20. Haoping Zheng, Phys. Rev. E 62, 5500 (2000).
21. Haoping Zheng, Prog. Phys. 20, 291 (2000).
22. P. Hohenberg and W. Kohn, Phys. Rev. 136, B864 (1964).
23. W. Kohn and L.J. Sham, Phys. Rev. 140, A1133 (1965).
24. A.M. Gronenborn, M. Nilges, R.J. Peanasky, and G.M. Clore, Biochemistry 29, 183 (1990).
25. B.L. Grasberger, G.M. Clore, and A.M. Gronenborn, Structure (London) 2, 669 (1994).
26. U. von Barth and L. Hedin, J. Phys. C 5, 1629 (1972).
27. A.K. Rajagopal, S. Singhal, and J. Kimball (unpublished)as quoted by A.K. Rajagopal, in Advances in Chemical Physics, edited by G.I. Prigogine and S.A. Rice (Wiley, New York, 1979), Vol. 41, p. 59.
28. H. Sambe and R.H. Felton, J. Chem. Phys. 62, 1122 (1975).