SCOPUS 정보 검색 플랫폼

Journal of Chemical Physics

Volumn 115, Issue 20, 2001, Pages 9169-9183

Calculating free energies using average force

(2) Darve, Eric a Pohorille, Andrew b,c

a STANFORD UNIVERSITY (United States)

b NASA AMES RESEARCH CENTER (United States)

c UNIVERSITY OF CALIFORNIA (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CHEMICAL BONDS; CHLORINE COMPOUNDS; COMPUTER SIMULATION; EQUATIONS OF MOTION; FLUORINE COMPOUNDS; HAMILTONIANS; INTERFACES (MATERIALS); NUMERICAL METHODS; PARAFFINS; PROBABILITY DENSITY FUNCTION; ROTATION; WATER;

AVERAGE FORCE; DICHLOROETHANE; FLUOROMETHANE; INSTANTANEOUS FORCE;

FREE ENERGY;

EID: 0035935802 PISSN: 00219606 EISSN: None Source Type: Journal
DOI: 10.1063/1.1410978 Document Type: Article

Times cited : (956)

References (41)

1
- 0002702771
- (1996) J. Chem. Phys. , vol.104 , pp. 286
- Ludemann, S.¹ Schreiber, H.² Abseher, R.³ Steinhauser, O.⁴

2
- 0000785131
- (1997) J. Chem. Phys. , vol.106 , pp. 9265
- Young, W.S.¹ Brooks, C.L.²

3
- 36749120002
- (1977) J. Chem. Phys. , vol.67 , pp. 3683
- Pratt, L.¹ Chandler, D.²

4
- 0032053619
- (1998) Curr. Opin. Struct. Biol. , vol.8 , pp. 222
- Brooks III, C.¹

5
- 0035865992
- (2001) Proteins , vol.42 , pp. 345
- Garcia, A.E.¹ Sanbonmatsu, K.Y.²

6
- 33751158845
- (1994) J. Phys. Chem. , vol.98 , pp. 4155
- Marrink, S.¹ Berendsen, H.²

7
- 0029972071
- (1996) J. Am. Chem. Soc. , vol.118 , pp. 6580
- Wilson, M.A.¹ Pohorille, A.²

8
- 0007428583
- edited by J. Lesczynski (Elsevier, Amsterdam); Theoretical and Computational Chemistry
- (1999) Computational Molecular Biology , pp. 485-526
- Pohorille, A.¹ Wilson, M.A.² Chipot, C.³ New, M.H.⁴ Schweighofer, K.S.⁵

9
- 0032491566
- (1998) J. Mol. Biol. , vol.283 , pp. 863
- Giraldo, J.¹ Wodak, S.J.² Van Belle, D.³

10
- 0032484151
- (1998) J. Mol. Biol. , vol.284 , pp. 835
- Schaefer, M.¹ Bartels, C.² Karplus, M.³

11
- 0034602373
- (2000) J. Mol. Biol. , vol.303 , pp. 567
- Wang, P.A.¹ Kollman, W.²

12
- 0029100207
- (1995) Annu. Rev. Biophys. Biomol. Struct. , vol.24 , pp. 677
- Rosenfeld, R.¹ Vajda, S.² DeLisi, C.³

13
- 0003399724
- (Academic, San Diego)
- (1986) Understanding Molecular Simulations
- Frenkel, D.¹ Smit, B.²

14
- 0030904524
- (1997) Curr. Opin. Struct. Biol. , vol.7 , pp. 181
- Berne, B.¹ Straub, J.²

15
- 0001114797
- (1998) Mol. Phys. , vol.94 , pp. 727
- Vlugt, T.¹ Martin, M.² Smit, B.³ Siepmann, J.⁴ Krishna, R.⁵

16
- 4243754128
- (1997) Phys. Rev. Lett. , vol.78 , pp. 2690
- Jarzynski, C.¹

17
- 4244116139
- (1997) Phys. Rev. E , vol.56 , pp. 5018
- Jarzynski, C.¹

18
- 0342929614
- (1977) J. Comput. Phys. , vol.23 , pp. 187
- Torrie, G.¹ Valleau, J.²

19
- 0003678550
- (Oxford University Press, Oxford)
- (1987) Introduction to Modern Statistical Mechanics
- Chandler, D.¹

20
- 84986519238
- (1992) J. Comput. Chem. , vol.13 , pp. 1011
- Kumar, S.¹ Bouzida, D.² Swendsen, R.³ Kollman, P.⁴ Rosenberg, J.⁵

21
- 84986497803
- (1995) J. Comput. Chem. , vol.16 , pp. 1339
- Kumar, S.¹ Rosenberg, J.² Bouzida, D.³ Swendsen, R.⁴ Kollman, P.⁵

22
- 0002531265
- edited by W. Van Gunsteren and P. Weiner (Escom, The Netherlands)
- (1989) Computer Simulation of Biomolecular Systems: Theoretical and Experimental Applications , pp. 27
- Van Gunsteren, W.¹

23
- 0001716036
- (1992) Chem. Phys. Lett. , vol.196 , pp. 297
- Straatsma, T.¹ Zacharias, M.² McCammon, J.³

24
- 0000606387
- (1996) J. Chem. Phys. , vol.104 , pp. 4869
- Mülders, A.¹ Krüger, P.² Swegat, W.³ Schlitter, J.⁴

25
- 0032529893
- (1998) J. Chem. Phys. , vol.109 , pp. 4139
- Den Otter, W.¹ Briels, W.²

26
- 0034691223
- (2000) Mol. Phys. , vol.98 , pp. 773
- Den Otter, W.K.¹ Briels, W.J.²

27
- 0001702831
- (1998) J. Chem. Phys. , vol.109 , pp. 7737
- Sprik, M.¹ Ciccotti, G.²

28
- 0001215308
- (1997) Mol. Phys. , vol.90 , pp. 925
- Ruiz-Montero, M.J.¹ Frenkel, D.² Brey, J.J.³

29
- 33646940952
- (1977) J. Comput. Phys. , vol.23 , pp. 327
- Ryckaert, J.¹ Cicotti, G.² Berendsen, H.³

30
- 48749148224
- (1983) J. Comput. Phys. , vol.52 , pp. 24
- Andersen, H.¹

31
- 0006857177
- (in press)
- Mol. Simul.
- Darve, E.¹ Wilson, M.A.² Pohorille, A.³

32
- 0000280446
- (2000) J. Chem. Phys. , vol.112 , pp. 7283
- Den Otter, W.K.¹

33
- 84870726202
- (Academic, New York)
- (1996) Understanding Molecular Simulation
- Frenkel, D.¹ Smit, B.²

34
- 0004016501
- (1983) J. Chem. Phys. , vol.79 , pp. 926
- Jorgensen, W.¹ Chandrasekhar, J.² Madura, J.³ Impey, R.⁴ Klein, M.⁵

35
- 0027538723
- (1993) J. Chem. Phys. , vol.98 , pp. 236
- Benjamin, I.¹ Pohorille, A.²

36
- 0030574691
- (1996) J. Chem. Phys. , vol.104 , pp. 3760
- Pohorille, A.¹ Wilson, M.A.²

37
- 0021515659
- (1984) J. Am. Chem. Soc. , vol.106 , pp. 6638
- Jorgensen, W.¹ Madura, J.² Swenson, C.³

38
- 36449000062
- (1992) J. Chem. Phys. , vol.97 , pp. 2635
- Martyna, G.¹ Klein, M.² Tuckerman, M.³

39
- 0000677910
- edited by J. Jortner, R. Levine, and B. Pullman (Kluwer, Dordrecht)
- (1993) Reaction Dynamics in Clusters and Condensed Phases - the Jerusalem Symposia on Quantum Chemistry and Biochemistry , vol.26 , pp. 207
- Pohorille, A.¹ Wilson, M.A.²

40
- 0030309180
- edited by L. Hunter and T. Klein (World Scientific, Singapore)
- (1996) Pacific Symposium on Biocomputing '96 , pp. 550-569
- Pohorille, A.¹ Chipot, C.² New, M.H.³ Wilson, M.A.⁴

41
- 0003990952
- (World Scientific, Singapore)
- (1999) Lectures on Differential Geometry
- Chern, S.¹ Chen, W.² Lam, K.³

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.