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Volumn 108, Issue 5, 1998, Pages 1964-1977

Transition path sampling and the calculation of rate constants

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EID: 0000729781     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.475562     Document Type: Article
Times cited : (972)

References (50)
  • 1
    • 0347193736 scopus 로고
    • P. Hänggi, P. Talkner, and M. Borkovec, Rev. Mod. Phys. 62, 251 (1990); B. J. Berne, in Multiple Time Scales, edited by J. U. Brackbill and B. I. Cohen (Academic Press, New York, 1985), pp. 419-436.
    • (1990) Rev. Mod. Phys. , vol.62 , pp. 251
    • Hänggi, P.1    Talkner, P.2    Borkovec, M.3
  • 2
    • 0002667922 scopus 로고
    • edited by J. U. Brackbill and B. I. Cohen Academic Press, New York
    • P. Hänggi, P. Talkner, and M. Borkovec, Rev. Mod. Phys. 62, 251 (1990); B. J. Berne, in Multiple Time Scales, edited by J. U. Brackbill and B. I. Cohen (Academic Press, New York, 1985), pp. 419-436.
    • (1985) Multiple Time Scales , pp. 419-436
    • Berne, B.J.1
  • 3
    • 0011703780 scopus 로고
    • J. C. Keck, Discuss. Faraday Soc. 33, 173 (1962); J. C. Keck, Adv. Chem. Phys. 13, 85 (1967); J. B. Anderson, J. Chem. Phys. 58, 4684 (1973); C. H. Bennett, in Algorithms for Chemical Computations, ACS Symposium Series No. 46, edited R. E. Christofferson (American Chemical Society, Washington, D.C., 1977), p. 63.
    • (1962) Discuss. Faraday Soc. , vol.33 , pp. 173
    • Keck, J.C.1
  • 4
    • 0011703780 scopus 로고
    • J. C. Keck, Discuss. Faraday Soc. 33, 173 (1962); J. C. Keck, Adv. Chem. Phys. 13, 85 (1967); J. B. Anderson, J. Chem. Phys. 58, 4684 (1973); C. H. Bennett, in Algorithms for Chemical Computations, ACS Symposium Series No. 46, edited R. E. Christofferson (American Chemical Society, Washington, D.C., 1977), p. 63.
    • (1967) Adv. Chem. Phys. , vol.13 , pp. 85
    • Keck, J.C.1
  • 5
    • 36849097384 scopus 로고
    • J. C. Keck, Discuss. Faraday Soc. 33, 173 (1962); J. C. Keck, Adv. Chem. Phys. 13, 85 (1967); J. B. Anderson, J. Chem. Phys. 58, 4684 (1973); C. H. Bennett, in Algorithms for Chemical Computations, ACS Symposium Series No. 46, edited R. E. Christofferson (American Chemical Society, Washington, D.C., 1977), p. 63.
    • (1973) J. Chem. Phys. , vol.58 , pp. 4684
    • Anderson, J.B.1
  • 6
    • 0011703780 scopus 로고
    • Algorithms for Chemical Computations, edited R. E. Christofferson American Chemical Society, Washington, D.C.
    • J. C. Keck, Discuss. Faraday Soc. 33, 173 (1962); J. C. Keck, Adv. Chem. Phys. 13, 85 (1967); J. B. Anderson, J. Chem. Phys. 58, 4684 (1973); C. H. Bennett, in Algorithms for Chemical Computations, ACS Symposium Series No. 46, edited R. E. Christofferson (American Chemical Society, Washington, D.C., 1977), p. 63.
    • (1977) ACS Symposium Series No. 46 , pp. 63
    • Bennett, C.H.1
  • 11
    • 36449003859 scopus 로고
    • C. J. Cerjan and W. H. Miller, J. Chem. Phys. 75, 2800 (1981); F. Jensen, ibid. 102, 6706 (1995).
    • (1995) J. Chem. Phys. , vol.102 , pp. 6706
    • Jensen, F.1
  • 13
    • 0000191981 scopus 로고
    • R. Czerminski and R. Elber, J. Chem. Phys. 92, 5580 (1990); R. Elber, D. P. Chen, D. Rojewska, and R. Eisenberg, Biophys. J. 68, 906 (1995).
    • (1990) J. Chem. Phys. , vol.92 , pp. 5580
    • Czerminski, R.1    Elber, R.2
  • 27
    • 36849137515 scopus 로고
    • M. N. Rosenbluth and A. W. Rosenbluth, J. Chem. Phys. 23, 356 (1955); J. I. Siepmann and D. Frenkel, Mol. Phys. 75, 59 (1992); J. J. de Pablo, M. Laso, and U. W. Suter, J. Chem Phys. 96, 2395 (1992); D. Frenkel, G. C. A. M. Mooij, and B. Smith, J. Phys. Condensed Matter 4, 3053 (1992).
    • (1955) J. Chem. Phys. , vol.23 , pp. 356
    • Rosenbluth, M.N.1    Rosenbluth, A.W.2
  • 28
    • 78650612270 scopus 로고
    • M. N. Rosenbluth and A. W. Rosenbluth, J. Chem. Phys. 23, 356 (1955); J. I. Siepmann and D. Frenkel, Mol. Phys. 75, 59 (1992); J. J. de Pablo, M. Laso, and U. W. Suter, J. Chem Phys. 96, 2395 (1992); D. Frenkel, G. C. A. M. Mooij, and B. Smith, J. Phys. Condensed Matter 4, 3053 (1992).
    • (1992) Mol. Phys. , vol.75 , pp. 59
    • Siepmann, J.I.1    Frenkel, D.2
  • 29
    • 0004265547 scopus 로고
    • M. N. Rosenbluth and A. W. Rosenbluth, J. Chem. Phys. 23, 356 (1955); J. I. Siepmann and D. Frenkel, Mol. Phys. 75, 59 (1992); J. J. de Pablo, M. Laso, and U. W. Suter, J. Chem Phys. 96, 2395 (1992); D. Frenkel, G. C. A. M. Mooij, and B. Smith, J. Phys. Condensed Matter 4, 3053 (1992).
    • (1992) J. Chem Phys. , vol.96 , pp. 2395
    • De Pablo, J.J.1    Laso, M.2    Suter, U.W.3
  • 30
    • 36149032570 scopus 로고
    • M. N. Rosenbluth and A. W. Rosenbluth, J. Chem. Phys. 23, 356 (1955); J. I. Siepmann and D. Frenkel, Mol. Phys. 75, 59 (1992); J. J. de Pablo, M. Laso, and U. W. Suter, J. Chem Phys. 96, 2395 (1992); D. Frenkel, G. C. A. M. Mooij, and B. Smith, J. Phys. Condensed Matter 4, 3053 (1992).
    • (1992) J. Phys. Condensed Matter , vol.4 , pp. 3053
    • Frenkel, D.1    Mooij, G.C.A.M.2    Smith, B.3
  • 32
    • 0040830978 scopus 로고
    • P. G. Higgs and H. Orland, J. Chem. Phys. 95, 4506 (1991); B. Velikson, T. Garel, J.-C. Niel, H. Orland, and J. C. Smith, J. Comput. Chem. 13, 1216 (1992).
    • (1991) J. Chem. Phys. , vol.95 , pp. 4506
    • Higgs, P.G.1    Orland, H.2
  • 34
    • 33748578711 scopus 로고
    • M. Parrinello and A. Rahman, J. Chem. Phys. 80, 860 (1984); M. E. Tuckerman, B. J. Berne, G. J. Martyna, and M. L. Klein, ibid. 99, 2796 (1993). 25 J. Polonyi and H. W. Wyld, Phys. Rev. Lett. 51, 2257 (1983); S. Sorella, S. Baroni, R. Car, and M. Parrinello, Europhys. Lett. 8, 663 (1989).
    • (1984) J. Chem. Phys. , vol.80 , pp. 860
    • Parrinello, M.1    Rahman, A.2
  • 35
    • 36448999094 scopus 로고
    • M. Parrinello and A. Rahman, J. Chem. Phys. 80, 860 (1984); M. E. Tuckerman, B. J. Berne, G. J. Martyna, and M. L. Klein, ibid. 99, 2796 (1993). 25 J. Polonyi and H. W. Wyld, Phys. Rev. Lett. 51, 2257 (1983); S. Sorella, S. Baroni, R. Car, and M. Parrinello, Europhys. Lett. 8, 663 (1989).
    • (1993) J. Chem. Phys. , vol.99 , pp. 2796
    • Tuckerman, M.E.1    Berne, B.J.2    Martyna, G.J.3    Klein, M.L.4
  • 36
    • 4243769855 scopus 로고
    • M. Parrinello and A. Rahman, J. Chem. Phys. 80, 860 (1984); M. E. Tuckerman, B. J. Berne, G. J. Martyna, and M. L. Klein, ibid. 99, 2796 (1993). 25 J. Polonyi and H. W. Wyld, Phys. Rev. Lett. 51, 2257 (1983); S. Sorella, S. Baroni, R. Car, and M. Parrinello, Europhys. Lett. 8, 663 (1989).
    • (1983) Phys. Rev. Lett. , vol.51 , pp. 2257
    • Polonyi, J.1    Wyld, H.W.2
  • 37
    • 84970082432 scopus 로고
    • M. Parrinello and A. Rahman, J. Chem. Phys. 80, 860 (1984); M. E. Tuckerman, B. J. Berne, G. J. Martyna, and M. L. Klein, ibid. 99, 2796 (1993). 25 J. Polonyi and H. W. Wyld, Phys. Rev. Lett. 51, 2257 (1983); S. Sorella, S. Baroni, R. Car, and M. Parrinello, Europhys. Lett. 8, 663 (1989).
    • (1989) Europhys. Lett. , vol.8 , pp. 663
    • Sorella, S.1    Baroni, S.2    Car, R.3    Parrinello, M.4
  • 42
    • 34547809547 scopus 로고
    • S. Nosé, J. Chem. Phys. 81, 511 (1984); W. G. Hoover, Phys. Rev. A 31, 1695 (1985).
    • (1984) J. Chem. Phys. , vol.81 , pp. 511
    • Nosé, S.1
  • 43
    • 0001538909 scopus 로고
    • S. Nosé, J. Chem. Phys. 81, 511 (1984); W. G. Hoover, Phys. Rev. A 31, 1695 (1985).
    • (1985) Phys. Rev. A , vol.31 , pp. 1695
    • Hoover, W.G.1


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