SCOPUS 정보 검색 플랫폼

Journal of Chemical Physics

Volumn 139, Issue 12, 2013, Pages

Nested sampling in the canonical ensemble: Direct calculation of the partition function from NVT trajectories

(1) Nielsen, Steven O a

a UNIVERSITY OF TEXAS AT DALLAS (United States)

Author keywords

[No Author keywords available]

Indexed keywords

FREE ENERGY; PHASE SPACE METHODS;

CANONICAL ENSEMBLE; DIRECT CALCULATION; EXPECTATION VALUES; MOLECULAR DYNAMICS SIMULATIONS; MOLECULAR SYSTEMS; PARTITION FUNCTIONS; SAMPLING PROCEDURES; SAMPLING TECHNIQUE;

MOLECULAR DYNAMICS;

EID: 84903362699 PISSN: 00219606 EISSN: None Source Type: Journal
DOI: 10.1063/1.4821761 Document Type: Article

Times cited : (36)

References (15)

1
- 35148901361
- 10.1214/06-BA127
- J. Skilling, J. Bayesian Anal. 1, 833 (2006). 10.1214/06-BA127
- (2006) J. Bayesian Anal. , vol.1 , pp. 833
- Skilling, J.¹

2
- 77955565010
- 10.1021/jp1012973
- L. B. Pártay, A. P. Bartók, and G. Csányi, J. Phys. Chem. B 114, 10502 (2010). 10.1021/jp1012973
- (2010) J. Phys. Chem. B , vol.114 , pp. 10502
- Pártay, L.B.¹ Bartók, A.P.² Csányi, G.³

3
- 80855128931
- 10.1063/1.3656296
- H. Do, J. D. Hirst, and R. J. Wheatley, J. Chem. Phys. 135, 174105 (2011). 10.1063/1.3656296
- (2011) J. Chem. Phys. , vol.135 , pp. 174105
- Do, H.¹ Hirst, J.D.² Wheatley, R.J.³

4
- 84872168301
- 10.1021/ct3007056
- H. Do and R. J. Wheatley, J. Chem. Theory Comput. 9, 165 (2013). 10.1021/ct3007056
- (2013) J. Chem. Theory Comput. , vol.9 , pp. 165
- Do, H.¹ Wheatley, R.J.²

5
- 84862676759
- 10.1146/annurev-chembioeng-062011-081032
- S. Singh, M. Chopra, and J. J. de Pablo, Annu. Rev. Chem. Biomol. Eng. 3, 369 (2012). 10.1146/annurev-chembioeng-062011-081032
- (2012) Annu. Rev. Chem. Biomol. Eng. , vol.3 , pp. 369
- Singh, S.¹ Chopra, M.² De Pablo, J.J.³

6
- 84857302692
- 10.1016/j.bpj.2011.12.053
- N. S. Burkoff, C. Várnai, S. A. Wells, and D. L. Wild, Biophys. J. 102, 878 (2012). 10.1016/j.bpj.2011.12.053
- (2012) Biophys. J. , vol.102 , pp. 878
- Burkoff, N.S.¹ Várnai, C.² Wells, S.A.³ Wild, D.L.⁴

7
- 84877771324
- 10.1063/1.4803162
- D. Mehta, J. D. Hauenstein, and D. J. Wales, J. Chem. Phys. 138, 171101 (2013). 10.1063/1.4803162
- (2013) J. Chem. Phys. , vol.138 , pp. 171101
- Mehta, D.¹ Hauenstein, J.D.² Wales, D.J.³

8
- 79551586433
- 10.1063/1.3530590
- M. Sicher, S. Mohr, and S. Goedecker, J. Chem. Phys. 134, 044106 (2011). 10.1063/1.3530590
- (2011) J. Chem. Phys. , vol.134 , pp. 044106
- Sicher, M.¹ Mohr, S.² Goedecker, S.³

9
- 84870569253
- 10.1063/1.4765060
- J. D. Doll, N. Plattner, D. L. Freeman, Y. F. Liu, and P. Dupuis, J. Chem. Phys. 137, 204112 (2012). 10.1063/1.4765060
- (2012) J. Chem. Phys. , vol.137 , pp. 204112
- Doll, J.D.¹ Plattner, N.² Freeman, D.L.³ Liu, Y.F.⁴ Dupuis, P.⁵

10
- 79960917917
- 10.1063/1.3609972
- M. Picciani, M. Athenes, J. Kurchan, and J. Tailleur, J. Chem. Phys. 135, 034108 (2011). 10.1063/1.3609972
- (2011) J. Chem. Phys. , vol.135 , pp. 034108
- Picciani, M.¹ Athenes, M.² Kurchan, J.³ Tailleur, J.⁴

11
- 0031599142
- 10.1145/272991.272995
- M. Matsumoto and T. Nishimura, ACM Trans. Model. Comput. Simul. 8, 3 (1998). 10.1145/272991.272995
- (1998) ACM Trans. Model. Comput. Simul. , vol.8 , pp. 3
- Matsumoto, M.¹ Nishimura, T.²

12
- 0041639988
- 10.1063/1.477658
- P. R. ten Wolde and D. Frenkel, J. Chem. Phys. 109, 9901 (1998). 10.1063/1.477658
- (1998) J. Chem. Phys. , vol.109 , pp. 9901
- Ten Wolde, P.R.¹ Frenkel, D.²

13
- 34547250219
- 10.1103/PhysRevE.75.056707
- G. Bussi and M. Parrinello, Phys. Rev. E 75, 056707 (2007). 10.1103/PhysRevE.75.056707
- (2007) Phys. Rev. e , vol.75 , pp. 056707
- Bussi, G.¹ Parrinello, M.²

14
- 31544435924
- 10.1063/1.448768
- D. L. Freeman and J. D. Doll, J. Chem. Phys. 82, 462 (1985). 10.1063/1.448768
- (1985) J. Chem. Phys. , vol.82 , pp. 462
- Freeman, D.L.¹ Doll, J.D.²

15
- 80051472308
- 10.1007/s11222-010-9198-8
- B. J. Brewer, L. B. Pártay, and G. Csányi, Stat. Comput. 21, 649 (2011). 10.1007/s11222-010-9198-8
- (2011) Stat. Comput. , vol.21 , pp. 649
- Brewer, B.J.¹ Pártay, L.B.² Csányi, G.³

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.