SCOPUS 정보 검색 플랫폼

Journal of Computational Chemistry

Volumn 35, Issue 5, 2014, Pages 343-359

Multipolar electrostatics for proteins: Atom-atom electrostatic energies in crambin

(3) Yuan, Yongna a,b Mills, Matthew J L a,c Popelier, Paul L A a

a UNIVERSITY OF MANCHESTER (United Kingdom)

b LANZHOU UNIVERSITY (China)

c UNIVERSITY OF SOUTHERN CALIFORNIA (United States)

Author keywords

A 1 42; ab initio; amino acids; convergence; crambin; electrostatics; force field; level of theory; Multipole Moments; peptides; protein; quantum chemical topology

Indexed keywords

AB INITIO; CONVERGENCE; CRAMBIN; FORCE FIELDS; LEVEL OF THEORY; MULTIPOLE MOMENTS; QUANTUM CHEMICAL TOPOLOGY;

AMINO ACIDS; DISSOCIATION; ELECTROSTATICS; PEPTIDES; PROTEINS; QUANTUM CHEMISTRY;

ATOMS;

CRAMBIN PROTEIN, CRAMBE ABYSSINICA; VEGETABLE PROTEIN;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; QUANTUM CHEMICAL TOPOLOGY • FORCE FIELD • ELECTROSTATICS • PROTEIN • AMINO ACIDS • PEPTIDES • LEVEL OF THEORY • AB INITIO • MULTIPOLE MOMENTS • CONVERGENCE • CRAMBIN • AΒ1-42; QUANTUM THEORY; STATIC ELECTRICITY;

QUANTUM CHEMICAL TOPOLOGY • FORCE FIELD • ELECTROSTATICS • PROTEIN • AMINO ACIDS • PEPTIDES • LEVEL OF THEORY • AB INITIO • MULTIPOLE MOMENTS • CONVERGENCE • CRAMBIN • AΒ1-42;

MODELS, MOLECULAR; PLANT PROTEINS; QUANTUM THEORY; STATIC ELECTRICITY;

EID: 84892895475 PISSN: 01928651 EISSN: 1096987X Source Type: Journal
DOI: 10.1002/jcc.23469 Document Type: Article

Times cited : (32)

References (75)

1
- 0029011701
- W. D. Cornell, P. Cieplak, C. I. Bayly, I. R. Gould, K. M. Merz, D. M. Ferguson, D. C. Spellmeyer, T. Fox, J. W. Caldwell, P. A. Kollman, J. Am. Chem. Soc. 2002, 117, 5179.
- (2002) J. Am. Chem. Soc. , vol.117 , pp. 5179
- Cornell, W.D.¹ Cieplak, P.² Bayly, C.I.³ Gould, I.R.⁴ Merz, K.M.⁵ Ferguson, D.M.⁶ Spellmeyer, D.C.⁷ Fox, T.⁸ Caldwell, J.W.⁹ Kollman, P.A.¹⁰

2
- 33748518255
- V. Hornak, R. Abel, A. Okur, B. Strockbine, A. Roitberg, C. Simmerling, Proteins: Struct. Funct. Bioinf. 2006, 65, 712.
- (2006) Proteins: Struct. Funct. Bioinf. , vol.65 , pp. 712
- Hornak, V.¹ Abel, R.² Okur, A.³ Strockbine, B.⁴ Roitberg, A.⁵ Simmerling, C.⁶

3
- 0942288583
- C. Sagui, L. G. Pedersen, T. A. Darden, J. Chem. Phys. 2004, 120, 73.
- (2004) J. Chem. Phys. , vol.120 , pp. 73
- Sagui, C.¹ Pedersen, L.G.² Darden, T.A.³

4
- 49449089306
- A. J. Stone, Science 2008, 321, 787.
- (2008) Science , vol.321 , pp. 787
- Stone, A.J.¹

5
- 19944400156
- G. M. Day, W. D. S. Motherwell, W. Jones, Cryst. Growth Des. 2005, 5, 1023.
- (2005) Cryst. Growth Des. , vol.5 , pp. 1023
- Day, G.M.¹ Motherwell, W.D.S.² Jones, W.³

6
- 0242443693
- J. W. Ponder, D. A. Case, Adv. Protein Chem. 2003, 66, 27.
- (2003) Adv. Protein Chem. , vol.66 , pp. 27
- Ponder, J.W.¹ Case, D.A.²

7
- 0028695270
- J. G. Vinter, J. Comput. Aided Mol. Des. 1994, 8, 653.
- (1994) J. Comput. Aided Mol. Des. , vol.8 , pp. 653
- Vinter, J.G.¹

8
- 36649010414
- N. Gresh, G. A. Cisneros, T. A. Darden, J.-P. Piquemal, J. Chem. Theory Comput. 2007, 3, 1960.
- (2007) J. Chem. Theory Comput. , vol.3 , pp. 1960
- Gresh, N.¹ Cisneros, G.A.² Darden, T.A.³ Piquemal, J.-P.⁴

9
- 2342642762
- R. J. Wheatley, A. S. Tulegenov, E. Bichoutskaia, Int. Rev. Phys. Chem. 2004, 23, 151.
- (2004) Int. Rev. Phys. Chem. , vol.23 , pp. 151
- Wheatley, R.J.¹ Tulegenov, A.S.² Bichoutskaia, E.³

10
- 77952344347
- A. Holt, J. Boström, G. Karlström, R. Lindh, J. Comput. Chem. 2010, 31, 1583.
- (2010) J. Comput. Chem. , vol.31 , pp. 1583
- Holt, A.¹ Boström, J.² Karlström, G.³ Lindh, R.⁴

11
- 30344486863
- G. M. Day, W. D. S. Motherwell, H. L. Ammon, S. X. M. Boerrigter, R. G. Della Valle, E. Venuti, A. Dzyabchenko, J. D. Dunitz, B. Schweizer, B. P. van Eijck, P. Erk, J. C. Facelli, V. E. Bazterra, M. B. Ferraro, D. W. M. Hofmann, F. J. J. Leusen, C. Liang, C. C. Pantelides, P. G. Karamertzanis, S. L. Price, T. C. Lewis, H. Nowell, A. Torrisi, H. A. Scheraga, Y. A. Arnautova, M. U. Schmidt, P. Verwer, Acta Crystallogr. Sect. B 2005, 61, 511.
- (2005) Acta Crystallogr. Sect. B , vol.61 , pp. 511
- Day, G.M.¹ Motherwell, W.D.S.² Ammon, H.L.³ Boerrigter, S.X.M.⁴ Della Valle, R.G.⁵ Venuti, E.⁶ Dzyabchenko, A.⁷ Dunitz, J.D.⁸ Schweizer, B.⁹ Van Eijck, B.P.¹⁰ Erk, P.¹¹ Facelli, J.C.¹² Bazterra, V.E.¹³ Ferraro, M.B.¹⁴ Hofmann, D.W.M.¹⁵ Leusen, F.J.J.¹⁶ Liang, C.¹⁷ Pantelides, C.C.¹⁸ Karamertzanis, P.G.¹⁹ Price, S.L.²⁰ more..

12
- 0043289936
- N. Gresh, J. E. Šponer, N. A. Špačková, J. Leszczynski, J. Šponer, J. Phys. Chem. B 2003, 107, 8669.
- (2003) J. Phys. Chem. B , vol.107 , pp. 8669
- Gresh, N.¹ Šponer, J.E.² Špačková, N.A.³ Leszczynski, J.⁴ Šponer, J.⁵

13
- 0025143912
- C. H. Faerman, S. L. Price, J. Am. Chem. Soc. 1990, 112, 4915.
- (1990) J. Am. Chem. Soc. , vol.112 , pp. 4915
- Faerman, C.H.¹ Price, S.L.²

14
- 0032212106
- C. Jelsch, V. Pichon-Pesme, C. Lecomte, A. Aubry, Acta Crystallogr Sect. D 1998, 54, 1306.
- (1998) Acta Crystallogr Sect. D , vol.54 , pp. 1306
- Jelsch, C.¹ Pichon-Pesme, V.² Lecomte, C.³ Aubry, A.⁴

15
- 84868141647
- M. Woinska, P. M. Dominiak, J. Phys. Chem. A 2013, 117, 1535.
- (2013) J. Phys. Chem. A , vol.117 , pp. 1535
- Woinska, M.¹ Dominiak, P.M.²

16
- 84986520814
- U. Koch, E. Egert, J. Comput. Chem. 1995, 16, 937.
- (1995) J. Comput. Chem. , vol.16 , pp. 937
- Koch, U.¹ Egert, E.²

17
- 84874819580
- C. Kramer, P. Gedeck, M. Meuwly, J. Chem. Theory Comput. 2013, 9, 1499.
- (2013) J. Chem. Theory Comput. , vol.9 , pp. 1499
- Kramer, C.¹ Gedeck, P.² Meuwly, M.³

18
- 1842504055
- K. E. Laidig, J. Phys. Chem. 1993, 97, 12760.
- (1993) J. Phys. Chem. , vol.97 , pp. 12760
- Laidig, K.E.¹

19
- 34548786766
- M. S. Gordon, L. Slipchenko, H. Li, J. H. Jensen, Annu. Rep. Comput. Chem. 2007, 3, 177.
- (2007) Annu. Rep. Comput. Chem. , vol.3 , pp. 177
- Gordon, M.S.¹ Slipchenko, L.² Li, H.³ Jensen, J.H.⁴

20
- 0033198697
- N. Gresh, H. Guo, D. R. Salahub, B. P. Roques, S. A. Kafafi, J. Am. Chem. Soc. 1999, 121, 7885.
- (1999) J. Am. Chem. Soc. , vol.121 , pp. 7885
- Gresh, N.¹ Guo, H.² Salahub, D.R.³ Roques, B.P.⁴ Kafafi, S.A.⁵

21
- 84866646533
- X. Zheng, C. Wu, J. W. Ponder, G. R. Marshall, J. Am. Chem. Soc. 2012, 134, 15970.
- (2012) J. Am. Chem. Soc. , vol.134 , pp. 15970
- Zheng, X.¹ Wu, C.² Ponder, J.W.³ Marshall, G.R.⁴

22
- 84892841361
- (in press).
- S. Cardamone, T. Hughes, P. L. A. Popelier, Chem. Soc. Rev. (in press).
- Chem. Soc. Rev.
- Cardamone, S.¹ Hughes, T.² Popelier, P.L.A.³

23
- 0037419798
- P. L. A. Popelier, F. M. Aicken, J. Am. Chem. Soc. 2003, 125, 1284.
- (2003) J. Am. Chem. Soc. , vol.125 , pp. 1284
- Popelier, P.L.A.¹ Aicken, F.M.²

24
- 0037416705
- P. L. A. Popelier, F. M. Aicken, Chem. Eur. J. 2003, 9, 1207.
- (2003) Chem. Eur. J. , vol.9 , pp. 1207
- Popelier, P.L.A.¹ Aicken, F.M.²

25
- 0004157499
- Oxford University Press: Oxford, Great Britain.
- R. F. W. Bader, Atoms in Molecules. A Quantum Theory; Oxford University Press: Oxford, Great Britain, 1990.
- (1990) Atoms in Molecules. A Quantum Theory
- Bader, R.F.W.¹

26
- 0003435922
- Pearson Education: London, Great Britain.
- P. L. A. Popelier, Atoms in Molecules. An Introduction; Pearson Education: London, Great Britain, 2000.
- (2000) Atoms in Molecules. An Introduction
- Popelier, P.L.A.¹

27
- 84860004756
- In; D. J. Wales, Ed.; Springer: Heidelberg, Germany, p.
- P. L. A. Popelier, In Structure and Bonding. Intermolecular Forces and Clusters, Vol. 115;, D. J. Wales, Ed.; Springer: Heidelberg, Germany, 2005; p. 1.
- (2005) Structure and Bonding. Intermolecular Forces and Clusters, Vol. 115 , pp. 1
- Popelier, P.L.A.¹

28
- 67649770453
- P. L. A. Popelier, É. A. G. Brémond, Int. J. Quantum Chem. 2009, 109, 2542.
- (2009) Int. J. Quantum Chem. , vol.109 , pp. 2542
- Popelier, P.L.A.¹ Brémond, É.A.G.²

29
- 0041830059
- P. L. A. Popelier, F. M. Aicken, Chem. Phys. Chem. 2003, 4, 824.
- (2003) Chem. Phys. Chem. , vol.4 , pp. 824
- Popelier, P.L.A.¹ Aicken, F.M.²

30
- 0035818123
- P. L. A. Popelier, L. Joubert, D. S. Kosov, J. Phys. Chem. A 2001, 105, 8254.
- (2001) J. Phys. Chem. A , vol.105 , pp. 8254
- Popelier, P.L.A.¹ Joubert, L.² Kosov, D.S.³

31
- 0035870732
- P. L. A. Popelier, D. S. Kosov, J. Chem. Phys. 2001, 114, 6539.
- (2001) J. Chem. Phys. , vol.114 , pp. 6539
- Popelier, P.L.A.¹ Kosov, D.S.²

32
- 0037058461
- L. Joubert, P. L. A. Popelier, Mol. Phys. 2002, 100, 3357.
- (2002) Mol. Phys. , vol.100 , pp. 3357
- Joubert, L.¹ Popelier, P.L.A.²

33
- 34547853487
- M. Rafat, P. L. A. Popelier, J. Chem. Phys. 2006, 124, 144102.
- (2006) J. Chem. Phys. , vol.124 , pp. 144102
- Rafat, M.¹ Popelier, P.L.A.²

34
- 28344432906
- M. Rafat, P. L. A. Popelier, J. Chem. Phys. 2005, 123, 204103.
- (2005) J. Chem. Phys. , vol.123 , pp. 204103
- Rafat, M.¹ Popelier, P.L.A.²

35
- 0034622742
- D. S. Kosov, P. L. A. Popelier, J. Chem. Phys. 2000, 113, 3969.
- (2000) J. Chem. Phys. , vol.113 , pp. 3969
- Kosov, D.S.¹ Popelier, P.L.A.²

36
- 0034245990
- D. S. Kosov, P. L. A. Popelier, J. Phys. Chem. A 2000, 104, 7339.
- (2000) J. Phys. Chem. A , vol.104 , pp. 7339
- Kosov, D.S.¹ Popelier, P.L.A.²

37
- 0038102740
- P. L. A. Popelier, M. Rafat, Chem. Phys. Lett. 2003, 376, 148.
- (2003) Chem. Phys. Lett. , vol.376 , pp. 148
- Popelier, P.L.A.¹ Rafat, M.²

38
- 77952994877
- C. J. F. Solano, A. M. Pendás, E. Francisco, M. A. Blanco, P. L. A. Popelier, J. Chem. Phys. 2010, 132, 194110.
- (2010) J. Chem. Phys. , vol.132 , pp. 194110
- Solano, C.J.F.¹ Pendás, A.M.² Francisco, E.³ Blanco, M.A.⁴ Popelier, P.L.A.⁵

39
- 0036384466
- L. Joubert, P. L. A. Popelier, Phys. Chem. Chem. Phys. 2002, 4, 4353.
- (2002) Phys. Chem. Chem. Phys. , vol.4 , pp. 4353
- Joubert, L.¹ Popelier, P.L.A.²

40
- 52149120342
- M. S. Shaik, M. Devereux, P. L. A. Popelier, Mol. Phys. 2008, 106, 1495.
- (2008) Mol. Phys. , vol.106 , pp. 1495
- Shaik, M.S.¹ Devereux, M.² Popelier, P.L.A.³

41
- 4544338888
- S. Y. Liem, P. L. A. Popelier, M. Leslie, Int. J. Quantum Chem. 2004, 99, 685.
- (2004) Int. J. Quantum Chem. , vol.99 , pp. 685
- Liem, S.Y.¹ Popelier, P.L.A.² Leslie, M.³

42
- 80053422148
- S. Y. Liem, M. S. Shaik, P. L. A. Popelier, J. Phys. Chem. B 2011, 115, 11389.
- (2011) J. Phys. Chem. B , vol.115 , pp. 11389
- Liem, S.Y.¹ Shaik, M.S.² Popelier, P.L.A.³

43
- 0042882127
- S. Liem, P. L. A. Popelier, J. Chem. Phys. 2003, 119, 4560.
- (2003) J. Chem. Phys. , vol.119 , pp. 4560
- Liem, S.¹ Popelier, P.L.A.²

44
- 49749130262
- S. Y. Liem, P. L. A. Popelier, J. Chem. Theory Comput. 2008, 4, 353.
- (2008) J. Chem. Theory Comput. , vol.4 , pp. 353
- Liem, S.Y.¹ Popelier, P.L.A.²

45
- 0003770889
- 1st ed.;.; Clarendon Press: Oxford.
- A. J. Stone, The Theory of Intermolecular Forces, 1st ed.; Vol. 32.; Clarendon Press: Oxford, 1996.
- (1996) The Theory of Intermolecular Forces , vol.32
- Stone, A.J.¹

46
- 68949154402
- C. M. Handley, G. I. Hawe, D. B. Kell, Popelier, Phys. Chem. Chem. Phys. 2009, 11, 6365.
- (2009) Phys. Chem. Chem. Phys. , vol.11 , pp. 6365
- Handley, C.M.¹ Hawe, G.I.² Kell, D.B.³ Popelier⁴

47
- 67650172396
- C. M. Handley, P. L. A. Popelier, J. Chem. Theory Comput. 2009, 5, 1474.
- (2009) J. Chem. Theory Comput. , vol.5 , pp. 1474
- Handley, C.M.¹ Popelier, P.L.A.²

48
- 58149214091
- M. G. Darley, C. M. Handley, P. L. A. Popelier, J. Chem. Theory Comput. 2008, 4, 1435.
- (2008) J. Chem. Theory Comput. , vol.4 , pp. 1435
- Darley, M.G.¹ Handley, C.M.² Popelier, P.L.A.³

49
- 80855127192
- M. J. L. Mills, P. L. A. Popelier, Comput. Theor. Chem. 2011, 975, 42.
- (2011) Comput. Theor. Chem. , vol.975 , pp. 42
- Mills, M.J.L.¹ Popelier, P.L.A.²

50
- 84856859897
- M. J. L. Mills, P. L. A. Popelier, Theor. Chem. Acc. 2012, 131, 1137.
- (2012) Theor. Chem. Acc. , vol.131 , pp. 1137
- Mills, M.J.L.¹ Popelier, P.L.A.²

51
- 84872738551
- P. L. A. Popelier, In AIP Conference Proceedings, Vol. 1456; 2012; pp. 261-268.
- AIP Conference Proceedings , vol.1456 , Issue.2012 , pp. 261-268
- Popelier, P.L.A.¹

52
- 84872246004
- P. L. A. Popelier, Curr. Top. Med. Chem. 2012, 12, 1924.
- (2012) Curr. Top. Med. Chem. , vol.12 , pp. 1924
- Popelier, P.L.A.¹

53
- 34548524218
- W. Wang, R. D. Skeel, J. Chem. Phys. 2005, 123, 164107.
- (2005) J. Chem. Phys. , vol.123 , pp. 164107
- Wang, W.¹ Skeel, R.D.²

54
- 84885130414
- M. J. Mills, G. I. Hawe, C. M. Handley, P. L. A. Popelier, Phys. Chem. Chem. Phys. 2013, 15, 18249.
- (2013) Phys. Chem. Chem. Phys. , vol.15 , pp. 18249
- Mills, M.J.¹ Hawe, G.I.² Handley, C.M.³ Popelier, P.L.A.⁴

55
- 33845183588
- D. R. Garmer, W. J. Stevens, J. Phys. Chem. 1989, 93, 8263.
- (1989) J. Phys. Chem. , vol.93 , pp. 8263
- Garmer, D.R.¹ Stevens, W.J.²

56
- 33847718279
- M. Rafat, P. L. A. Popelier, J. Comput. Chem. 2007, 28, 832.
- (2007) J. Comput. Chem. , vol.28 , pp. 832
- Rafat, M.¹ Popelier, P.L.A.²

57
- 6844256141
- C. H. Van Etten, H. C. Nielson, J. E. Peters, Phytochemistry 1965, 4, 467.
- (1965) Phytochemistry , vol.4 , pp. 467
- Van Etten, C.H.¹ Nielson, H.C.² Peters, J.E.³

58
- 1642338816
- J. P. Ritchie, Chem. Phys. Lett. 2004, 387, 243.
- (2004) Chem. Phys. Lett. , vol.387 , pp. 243
- Ritchie, J.P.¹

59
- 0012601229
- B. A. Wallace, N. Kohl, M. M. Teeter, Proc. Natl. Acad. Sci. 1984, 81, 1406.
- (1984) Proc. Natl. Acad. Sci. , vol.81 , pp. 1406
- Wallace, B.A.¹ Kohl, N.² Teeter, M.M.³

60
- 0030460119
- L. Lobb, B. Stec, E. K. Kantrowitz, A. Yamano, V. Stojanoff, O Markman, M. M. Teeter, Protein Eng. 1996, 9, 1233.
- (1996) Protein Eng. , vol.9 , pp. 1233
- Lobb, L.¹ Stec, B.² Kantrowitz, E.K.³ Yamano, A.⁴ Stojanoff, V.⁵ Markman, O.⁶ Teeter, M.M.⁷

61
- 1042288183
- D. Bang, N. Chopra, S. B. H. Kent, J. Am. Chem. Soc. 2004, 126, 1377.
- (2004) J. Am. Chem. Soc. , vol.126 , pp. 1377
- Bang, D.¹ Chopra, N.² Kent, S.B.H.³

62
- 0030083713
- P. L. A. Popelier, Comput. Phys. Commun. 1996, 93, 212.
- (1996) Comput. Phys. Commun. , vol.93 , pp. 212
- Popelier, P.L.A.¹

63
- 25444475238
- M. Rafat, M. Devereux, P. L. A. Popelier, J. Mol. Graph. Model. 2005, 24, 111.
- (2005) J. Mol. Graph. Model. , vol.24 , pp. 111
- Rafat, M.¹ Devereux, M.² Popelier, P.L.A.³

64
- 0034122243
- F. M. Aicken, P. L. A. Popelier, Can. J. Chem. 2000, 78, 415.
- (2000) Can. J. Chem. , vol.78 , pp. 415
- Aicken, F.M.¹ Popelier, P.L.A.²

65
- 84892871993
- PhD thesis; UMIST: Manchester.
- M. Rafat, PhD thesis; UMIST: Manchester, 2005.
- (2005)
- Rafat, M.¹

66
- 0030603952
- C. Haettig, Chem. Phys. Lett. 1996, 260, 341.
- (1996) Chem. Phys. Lett. , vol.260 , pp. 341
- Haettig, C.¹

67
- 84892873643
- AIMAll, Available at Accessed 14 Oct 2013.
- T. A. Keith, AIMAll, 1997-2010. Available at: http://aim.tkgristmill.com. Accessed 14 Oct 2013.
- Keith, T.A.¹

68
- 35948945764
- 1st ed. University of Oviedo: Spain.
- A. M. Pendas, V. Luana, PROMOLDEN, 1st ed.; University of Oviedo: Spain, 2002.
- (2002) PROMOLDEN
- Pendas, A.M.¹ Luana, V.²

69
- 33750403997
- L. Lorenzo, M. J. G. Moa, M. Mandado, R. A. Mosquera, J. Chem. Inf. Model. 2006, 46, 2056.
- (2006) J. Chem. Inf. Model. , vol.46 , pp. 2056
- Lorenzo, L.¹ Moa, M.J.G.² Mandado, M.³ Mosquera, R.A.⁴

70
- 0011057301
- F. Vigne-Maeder, P. Claverie, J. Chem. Phys. 1988, 88, 4934.
- (1988) J. Chem. Phys. , vol.88 , pp. 4934
- Vigne-Maeder, F.¹ Claverie, P.²

71
- 0000138517
- P. N. Day, J. H. Jensen, M. S. Gordon, S. P. Webb, W. J. Stevens, M. Kraus, D. Garmer, H. Basch, D. Cohen, J. Chem. Phys. 1996, 105, 1968.
- (1996) J. Chem. Phys. , vol.105 , pp. 1968
- Day, P.N.¹ Jensen, J.H.² Gordon, M.S.³ Webb, S.P.⁴ Stevens, W.J.⁵ Kraus, M.⁶ Garmer, D.⁷ Basch, H.⁸ Cohen, D.⁹

72
- 0037058461
- L. Joubert, P. L. A. Popelier, Mol. Phys. 2002, 100, 3357.
- (2002) Mol. Phys. , vol.100 , pp. 3357
- Joubert, L.¹ Popelier, P.L.A.²

73
- 0035138053
- M. S. Gordon, M. A. Freitag, P. Bandyopadhyay, J. H. Jensen, V. Kairys, W. J. Stevens, J. Phys. Chem. A 2001, 105, 293.
- (2001) J. Phys. Chem. A , vol.105 , pp. 293
- Gordon, M.S.¹ Freitag, M.A.² Bandyopadhyay, P.³ Jensen, J.H.⁴ Kairys, V.⁵ Stevens, W.J.⁶

74
- 0346317394
- J.-P. Piquemal, N. Gresh, C. Giessner-Prettre, J. Phys. Chem. A 2003, 107, 10353.
- (2003) J. Phys. Chem. A , vol.107 , pp. 10353
- Piquemal, J.-P.¹ Gresh, N.² Giessner-Prettre, C.³

75
- 0029878720
- W. Humphrey, A. Dalke, K. Schulten, J. Molec. Graphics 1996, 14, 33.
- (1996) J. Molec. Graphics , vol.14 , pp. 33
- Humphrey, W.¹ Dalke, A.² Schulten, K.³

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.