SCOPUS 정보 검색 플랫폼

Journal of Molecular Structure: THEOCHEM

Volumn 675, Issue 1-3, 2004, Pages 149-162

A Hartree-Fock, MP2 and DFT computational study of the structures and energies of ″b2 ions derived from deprotonated peptides. A comparison of method and basis set used on relative product stabilities

(5) Chass, Gregory A a,b,c Marai, Christopher N J a,b Setiadi, David H a,b Csizmadia, Imre G a,d Harrison, Alex G a

a UNIVERSITY OF TORONTO (Canada)

b Global Inst Compl Molec Mat Sci (Canada)

c Centre National de la Recherche Scientifique (France)

d UNIVERSITY OF SZEGED (Hungary)

Author keywords

Collisional activation; Computational study; Deprotonated peptides

Indexed keywords

ANION; ION; PEPTIDE;

ACIDITY; ARTICLE; CALCULATION; DENSITY FUNCTIONAL THEORY; ENERGY; FRAGMENTATION REACTION; INTERMETHOD COMPARISON; MOLECULAR STABILITY; PROTEIN STRUCTURE; PROTON TRANSPORT; STRUCTURE ANALYSIS;

EID: 2342505844 PISSN: 01661280 EISSN: None Source Type: Journal
DOI: 10.1016/j.theochem.2003.12.040 Document Type: Article

Times cited : (19)

References (38)

1
- 84987419408
- Roepstorff P., Fohlman J. Biomed. Mass Spectrom. 11:1984;601
- (1984) Biomed. Mass Spectrom. , vol.11 , pp. 601
- Roepstorff, P.¹ Fohlman, J.²

2
- 0023804303
- Biemann K. Biomed. Env. Mass Spectrom. 16:1988;99
- (1988) Biomed. Env. Mass Spectrom. , vol.16 , pp. 99
- Biemann, K.¹

3
- 0025670535
- Biemann K. Methods Enzymol. 193:1990;455
- (1990) Methods Enzymol. , vol.193 , pp. 455
- Biemann, K.¹

4
- 0842285056
- Papayannopoulos I.A. Mass Spectrom. Rev. 14:1995;49
- (1995) Mass Spectrom. Rev. , vol.14 , pp. 49
- Papayannopoulos, I.A.¹

5
- 84987044301
- Mueller D.R., Eckersley M., Richter W. Org. Mass Spectrom. 23:1988;217
- (1988) Org. Mass Spectrom. , vol.23 , pp. 217
- Mueller, D.R.¹ Eckersley, M.² Richter, W.³

6
- 0027618667
- Cordero M.M., Houser J.J., Wesdemiotis C. Anal. Chem. 65:1993;1594
- (1993) Anal. Chem. , vol.65 , pp. 1594
- Cordero, M.M.¹ Houser, J.J.² Wesdemiotis, C.³

7
- 58149324705
- Yalcin T., Khouw C., Csizmadia I.G., Peterson M.R., Harrison A.G. J. Am. Soc. Mass Spectrom. 6:1995;1165
- (1995) J. Am. Soc. Mass Spectrom. , vol.6 , pp. 1165
- Yalcin, T.¹ Khouw, C.² Csizmadia, I.G.³ Peterson, M.R.⁴ Harrison, A.G.⁵

8
- 0001001295
- Yalcin T., Csizmadia I.G., Peterson M.R., Harrison A.G. J. Am. Soc. Mass Spectrom. 7:1996;293
- (1996) J. Am. Soc. Mass Spectrom. , vol.7 , pp. 293
- Yalcin, T.¹ Csizmadia, I.G.² Peterson, M.R.³ Harrison, A.G.⁴

9
- 0000197230
- Nold M.J., Wesdemiotis C., Yalcin T., Harrison A.G. Int. J. Mass Spectrom. 164:1997;137
- (1997) Int. J. Mass Spectrom. , vol.164 , pp. 137
- Nold, M.J.¹ Wesdemiotis, C.² Yalcin, T.³ Harrison, A.G.⁴

10
- 0033060734
- Paizs B., Lendvay G., Vékey K., Suhai S. Rapid Commun. Mass Spectrom. 13:1997;525
- (1997) Rapid Commun. Mass Spectrom. , vol.13 , pp. 525
- Paizs, B.¹ Lendvay, G.² Vékey, K.³ Suhai, S.⁴

11
- 0034351823
- Harrison A.G., Csizmadia I.G., Tang T.-H. J. Am. Soc. Mass Spectrom. 11:2000;427
- (2000) J. Am. Soc. Mass Spectrom. , vol.11 , pp. 427
- Harrison, A.G.¹ Csizmadia, I.G.² Tang, T.-H.³

12
- 0033746906
- Rodriquez C.F., Schoeib T., Chu I.K., Siu K.W.M., Hopkinson A.C. J. Phys. Chem. A. 104:2000;5335
- (2000) J. Phys. Chem. a , vol.104 , pp. 5335
- Rodriquez, C.F.¹ Schoeib, T.² Chu, I.K.³ Siu, K.W.M.⁴ Hopkinson, A.C.⁵

13
- 0035860166
- Farrugia J.M., O'Hair R.A.J., Reid G.E. Int. J. Mass Spectrom. 210/211:2001;71
- (2001) Int. J. Mass Spectrom. , vol.210-211 , pp. 71
- Farrugia, J.M.¹ O'Hair, R.A.J.² Reid, G.E.³

14
- 0024423506
- Kulik W., Heerma W. Biomed. Env. Mass Spectrom. 18:1989;910
- (1989) Biomed. Env. Mass Spectrom. , vol.18 , pp. 910
- Kulik, W.¹ Heerma, W.²

15
- 0025063727
- van Setten D., Kulik W., Heerma W. Biomed. Env. Mass Spectrom. 19:1990;475
- (1990) Biomed. Env. Mass Spectrom. , vol.19 , pp. 475
- Van Setten, D.¹ Kulik, W.² Heerma, W.³

16
- 84989078346
- Eckersley M., Bowie J.H., Hayes R.N. Org. Mass Spectrom. 24:1989;597
- (1989) Org. Mass Spectrom. , vol.24 , pp. 597
- Eckersley, M.¹ Bowie, J.H.² Hayes, R.N.³

17
- 0027950355
- Waugh R.J., Bowie J.H. Rapid Commun. Mass Spectrom. 8:1994;169
- (1994) Rapid Commun. Mass Spectrom. , vol.8 , pp. 169
- Waugh, R.J.¹ Bowie, J.H.²

18
- 0035564364
- Harrison A.G. J. Am. Soc. Mass Spectrom. 12:2001;1
- (2001) J. Am. Soc. Mass Spectrom. , vol.12 , pp. 1
- Harrison, A.G.¹

19
- 0037260331
- Aribi
- Harrison A.G., Siu K.W.M., El H. Aribi. Rapid Commun. Mass Spectrom. 17:2003;869
- (2003) Rapid Commun. Mass Spectrom. , vol.17 , pp. 869
- Harrison, A.G.¹ Siu, K.W.M.² El, H.³

20
- 0000835721
- Bradford A.M., Waugh R.J., Bowie J.H., Vollmer D.L., Gross M.L. Int. J. Mass Spectrom. Ion Processes. 136:1994;143
- (1994) Int. J. Mass Spectrom. Ion Processes , vol.136 , pp. 143
- Bradford, A.M.¹ Waugh, R.J.² Bowie, J.H.³ Vollmer, D.L.⁴ Gross, M.L.⁵

21
- 0004133516
- Gaussian Inc., Pittsburgh, PA
- 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. Mennuccci, C. Pomelli, C. Adamo, S. Clifford, J. Ochterski, G.A. Petersson, P.A. Ayala, Q. Cui, K. Morokuma, P. Salvador, J.J. Dannenberg, D.K. Malick, A.B. Rabuck, K. Ragavachari, 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, M. Challacombe, P.M.W. Gill, B. Johnson, W. Chen, M.W. Wong, J.L. Andres, C. Gonzalez, M. Head-Gordon, E.S., Replogle, J.A., Pople. GAUSSIAN 98, Revision A.11, Gaussian Inc., Pittsburgh, PA (2001).
- (2001) GAUSSIAN 98, Revision A.11
- Frisch, M.J.¹ Trucks, G.W.² Schlegel, H.B.³ Scuseria, G.E.⁴ Robb, M.A.⁵ Cheeseman, J.R.⁶ Zakrzewski, V.G.⁷ Montgomery Jr., J.A.⁸ Stratmann, R.E.⁹ Burant, J.C.¹⁰ Dapprich, S.¹¹ Millam, J.M.¹² Daniels, A.D.¹³ Kudin, K.N.¹⁴ Strain, M.C.¹⁵ Farkas, O.¹⁶ Tomasi, J.¹⁷ Barone, V.¹⁸ Cossi, M.¹⁹ Cammi, R.²⁰ more..

22
- 0037108182
- Chass G.A., Sahai M.A., Law J.M.S., Lovas S., Farkas Ö., Perczel A., Rivail J.L., Csizmadia I.G. Int. J. Quantum Chem. 90:2002;933
- (2002) Int. J. Quantum Chem. , vol.90 , pp. 933
- Chass, G.A.¹ Sahai, M.A.² Law, J.M.S.³ Lovas, S.⁴ Farkas, Ö.⁵ Perczel, A.⁶ Rivail, J.L.⁷ Csizmadia, I.G.⁸

23
- 2342486496
- Sahai M.A., Chass G.A., Penke B., Csizmadia I.G. J. Mol. Struct. (THEOCHEM). 169:2004;666-667
- (2004) J. Mol. Struct. (THEOCHEM) , vol.169 , pp. 666-667
- Sahai, M.A.¹ Chass, G.A.² Penke, B.³ Csizmadia, I.G.⁴

24
- 0039719399
- Arch. Biochem. Biophys. 145 (1971) 405; Biochem J. 121 (1971) 121; Biochemistry J. 9 (1971) 3471; Biochim. Biophys. Acta 229 (1971) 1; Eur. J. Biochem. 17 (1969) 193; J. Biol. Chem. 245 (1970) 245; J. Mol. Biol. 52 (1970) 1; Pure Appl. Chem. 40 (1974) 291; Biochemical Nomenclature and Related Documents, 2nd Ed., Portland Press (1992) pp. 73-81.
- (1971) Arch. Biochem. Biophys. , vol.145 , pp. 405

25
- 0039719399
- Arch. Biochem. Biophys. 145 (1971) 405; Biochem J. 121 (1971) 121; Biochemistry J. 9 (1971) 3471; Biochim. Biophys. Acta 229 (1971) 1; Eur. J. Biochem. 17 (1969) 193; J. Biol. Chem. 245 (1970) 245; J. Mol. Biol. 52 (1970) 1; Pure Appl. Chem. 40 (1974) 291; Biochemical Nomenclature and Related Documents, 2nd Ed., Portland Press (1992) pp. 73-81.
- (1971) Biochem J. , vol.121 , pp. 121

26
- 0039719399
- Arch. Biochem. Biophys. 145 (1971) 405; Biochem J. 121 (1971) 121; Biochemistry J. 9 (1971) 3471; Biochim. Biophys. Acta 229 (1971) 1; Eur. J. Biochem. 17 (1969) 193; J. Biol. Chem. 245 (1970) 245; J. Mol. Biol. 52 (1970) 1; Pure Appl. Chem. 40 (1974) 291; Biochemical Nomenclature and Related Documents, 2nd Ed., Portland Press (1992) pp. 73-81.
- (1971) Biochemistry J. , vol.9 , pp. 3471

27
- 0039719399
- Arch. Biochem. Biophys. 145 (1971) 405; Biochem J. 121 (1971) 121; Biochemistry J. 9 (1971) 3471; Biochim. Biophys. Acta 229 (1971) 1; Eur. J. Biochem. 17 (1969) 193; J. Biol. Chem. 245 (1970) 245; J. Mol. Biol. 52 (1970) 1; Pure Appl. Chem. 40 (1974) 291; Biochemical Nomenclature and Related Documents, 2nd Ed., Portland Press (1992) pp. 73-81.
- (1971) Biochim. Biophys. Acta , vol.229 , pp. 1

28
- 84984426134
- Arch. Biochem. Biophys. 145 (1971) 405; Biochem J. 121 (1971) 121; Biochemistry J. 9 (1971) 3471; Biochim. Biophys. Acta 229 (1971) 1; Eur. J. Biochem. 17 (1969) 193; J. Biol. Chem. 245 (1970) 245; J. Mol. Biol. 52 (1970) 1; Pure Appl. Chem. 40 (1974) 291; Biochemical Nomenclature and Related Documents, 2nd Ed., Portland Press (1992) pp. 73-81.
- (1969) Eur. J. Biochem. , vol.17 , pp. 193

29
- 0039719399
- Arch. Biochem. Biophys. 145 (1971) 405; Biochem J. 121 (1971) 121; Biochemistry J. 9 (1971) 3471; Biochim. Biophys. Acta 229 (1971) 1; Eur. J. Biochem. 17 (1969) 193; J. Biol. Chem. 245 (1970) 245; J. Mol. Biol. 52 (1970) 1; Pure Appl. Chem. 40 (1974) 291; Biochemical Nomenclature and Related Documents, 2nd Ed., Portland Press (1992) pp. 73-81.
- (1970) J. Biol. Chem. , vol.245 , pp. 245

30
- 0039719399
- Arch. Biochem. Biophys. 145 (1971) 405; Biochem J. 121 (1971) 121; Biochemistry J. 9 (1971) 3471; Biochim. Biophys. Acta 229 (1971) 1; Eur. J. Biochem. 17 (1969) 193; J. Biol. Chem. 245 (1970) 245; J. Mol. Biol. 52 (1970) 1; Pure Appl. Chem. 40 (1974) 291; Biochemical Nomenclature and Related Documents, 2nd Ed., Portland Press (1992) pp. 73-81.
- (1970) J. Mol. Biol. , vol.52 , pp. 1

31
- 84855848759
- Arch. Biochem. Biophys. 145 (1971) 405; Biochem J. 121 (1971) 121; Biochemistry J. 9 (1971) 3471; Biochim. Biophys. Acta 229 (1971) 1; Eur. J. Biochem. 17 (1969) 193; J. Biol. Chem. 245 (1970) 245; J. Mol. Biol. 52 (1970) 1; Pure Appl. Chem. 40 (1974) 291; Biochemical Nomenclature and Related Documents, 2nd Ed., Portland Press (1992) pp. 73-81.
- (1974) Pure Appl. Chem. , vol.40 , pp. 291

32
- 0039719399
- Portland Press
- Arch. Biochem. Biophys. 145 (1971) 405; Biochem J. 121 (1971) 121; Biochemistry J. 9 (1971) 3471; Biochim. Biophys. Acta 229 (1971) 1; Eur. J. Biochem. 17 (1969) 193; J. Biol. Chem. 245 (1970) 245; J. Mol. Biol. 52 (1970) 1; Pure Appl. Chem. 40 (1974) 291; Biochemical Nomenclature and Related Documents, 2nd Ed., Portland Press (1992) pp. 73-81.
- (1992) Biochemical Nomenclature and Related Documents, 2nd Ed. , pp. 73-81

33
- 0038292973
- Perczel A., Angyan J.G., Kajtar M., Vaviani W., Rivail J.L., Marcoccia J.F., Csizmadia I.G. J. Am. Chem. Soc. 113:1991;6256
- (1991) J. Am. Chem. Soc. , vol.113 , pp. 6256
- Perczel, A.¹ Angyan, J.G.² Kajtar, M.³ Vaviani, W.⁴ Rivail, J.L.⁵ Marcoccia, J.F.⁶ Csizmadia, I.G.⁷

34
- 0011083273
- Scott A.P., Radom L. J. Phys. Chem. 100:1996;16502
- (1996) J. Phys. Chem. , vol.100 , pp. 16502
- Scott, A.P.¹ Radom, L.²

35
- 85005693478
- Peng C., Schlegel H.B. Israel J. Chem. 33:1993;449
- (1993) Israel J. Chem. , vol.33 , pp. 449
- Peng, C.¹ Schlegel, H.B.²

36
- 0002947357
- Peng C., Ayala P.Y., Schlegel H.B., Frisch M.J. Comp. Chem. 16:1995;49
- (1995) Comp. Chem. , vol.16 , pp. 49
- Peng, C.¹ Ayala, P.Y.² Schlegel, H.B.³ Frisch, M.J.⁴

37
- 0034516862
- Polce M.J., Ren D., Wesdemiotis C. J. Mass Spectrom. 35:2000;1391
- (2000) J. Mass Spectrom. , vol.35 , pp. 1391
- Polce, M.J.¹ Ren, D.² Wesdemiotis, C.³

38
- 2342631090
- Lias S.G., Bartmess J.E., Liebman J.F., Holmes J.L., Levin R.D., Mallard W.G. J. Phys. Chem. Ref. Data. 17:(Suppl. 1):1988
- (1988) J. Phys. Chem. Ref. Data , vol.17 , Issue.SUPPL. 1
- Lias, S.G.¹ Bartmess, J.E.² Liebman, J.F.³ Holmes, J.L.⁴ Levin, R.D.⁵ Mallard, W.G.⁶

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.