SCOPUS 정보 검색 플랫폼

Molecular BioSystems

Volumn 11, Issue 12, 2015, Pages 3347-3354

Interaction mechanism exploration of R-bicalutamide/S-1 with WT/W741L AR using molecular dynamics simulations

(6) Liu, Hongli a An, Xiaoli a Li, Shuyan a Wang, Yuwei a Li, Jiazhong a,b Liu, Huanxiang a

a LANZHOU UNIVERSITY (China)

b Lanzhou Institute of Physics (China)

Author keywords

[No Author keywords available]

Indexed keywords

ANDROGEN RECEPTOR; ANDROGEN RECEPTOR ANTAGONIST; ANILIDE; BICALUTAMIDE; LIGAND; NITRILE; PROTEIN BINDING; TOLUENESULFONIC ACID DERIVATIVE;

ALGORITHM; CHEMICAL STRUCTURE; CHEMISTRY; CONFORMATION; GENETICS; HUMAN; METABOLISM; MOLECULAR DYNAMICS; MUTATION; STRUCTURE ACTIVITY RELATION;

ALGORITHMS; ANDROGEN RECEPTOR ANTAGONISTS; ANILIDES; HUMANS; LIGANDS; MODELS, MOLECULAR; MOLECULAR CONFORMATION; MOLECULAR DYNAMICS SIMULATION; MOLECULAR STRUCTURE; MUTATION; NITRILES; PROTEIN BINDING; RECEPTORS, ANDROGEN; STRUCTURE-ACTIVITY RELATIONSHIP; TOSYL COMPOUNDS;

EID: 84946896738 PISSN: 1742206X EISSN: 17422051 Source Type: Journal
DOI: 10.1039/c5mb00499c Document Type: Article

Times cited : (29)

References (56)

1
- 0033030842
- E. Ruijter C. Van De Kaa G. Miller D. Ruiter F. Debruyne J. Schalken Endocr. Rev. 1999 20 22 45
- (1999) Endocr. Rev. , vol.20 , pp. 22-45
- Ruijter, E.¹ Van De Kaa, C.² Miller, G.³ Ruiter, D.⁴ Debruyne, F.⁵ Schalken, J.⁶

2
- 84920837701
- R. L. Siegel K. D. Miller A. Jemal Ca-Cancer J. Clin. 2015 65 5 29
- (2015) Ca-Cancer J. Clin. , vol.65 , pp. 5-29
- Siegel, R.L.¹ Miller, K.D.² Jemal, A.³

3
- 84904155440
- C. E. DeSantis C. C. Lin A. B. Mariotto R. L. Sieqel J. L. Kramer R. Alteri A. S. Robbins A. Jemal Ca-Cancer J. Clin. 2014 64 252 271
- (2014) Ca-Cancer J. Clin. , vol.64 , pp. 252-271
- DeSantis, C.E.¹ Lin, C.C.² Mariotto, A.B.³ Sieqel, R.L.⁴ Kramer, J.L.⁵ Alteri, R.⁶ Robbins, A.S.⁷ Jemal, A.⁸

4
- 25444496757
- W. Gao C. E. Bohl J. T. Dalton Chem. Rev. 2005 105 3352 3370
- (2005) Chem. Rev. , vol.105 , pp. 3352-3370
- Gao, W.¹ Bohl, C.E.² Dalton, J.T.³

5
- 67549142234
- M. L. Mohler C. E. Bohl A. Jones C. C. Coss R. Narayanan Y. He D. J. Hwang J. T. Dalton D. D. Miller J. Med. Chem. 2009 52 3597 3617
- (2009) J. Med. Chem. , vol.52 , pp. 3597-3617
- Mohler, M.L.¹ Bohl, C.E.² Jones, A.³ Coss, C.C.⁴ Narayanan, R.⁵ He, Y.⁶ Hwang, D.J.⁷ Dalton, J.T.⁸ Miller, D.D.⁹

6
- 59049096464
- R. Narayanan M. L. Mohler C. E. Bohl D. D. Miller J. T. Dalton Nucl. Recept. Signaling 2008 6 e010
- (2008) Nucl. Recept. Signaling , vol.6 , pp. e010
- Narayanan, R.¹ Mohler, M.L.² Bohl, C.E.³ Miller, D.D.⁴ Dalton, J.T.⁵

7
- 0035496220
- B. J. Feldman D. Feldman Nat. Rev. Cancer 2001 1 34 45
- (2001) Nat. Rev. Cancer , vol.1 , pp. 34-45
- Feldman, B.J.¹ Feldman, D.²

8
- 0036219918
- C. A. Heinlein C. Chang Endocr. Rev. 2002 23 175 200
- (2002) Endocr. Rev. , vol.23 , pp. 175-200
- Heinlein, C.A.¹ Chang, C.²

9
- 36448945245
- U. Srinivas-Shankar F. C. Wu Nat. Clin. Pract. Urol. 2006 3 653 665
- (2006) Nat. Clin. Pract. Urol. , vol.3 , pp. 653-665
- Srinivas-Shankar, U.¹ Wu, F.C.²

10
- 0029618368
- M. Beato P. Herrlich G. Schütz Cell 1995 83 851 857
- (1995) Cell , vol.83 , pp. 851-857
- Beato, M.¹ Herrlich, P.² Schütz, G.³

11
- 33746623315
- S. M. Dehm D. J. Tindall J. Cell. Biochem. 2006 99 333 344
- (2006) J. Cell. Biochem. , vol.99 , pp. 333-344
- Dehm, S.M.¹ Tindall, D.J.²

12
- 2342558431
- C. A. Heinlein C. Chang Endocr. Rev. 2004 25 276 308
- (2004) Endocr. Rev. , vol.25 , pp. 276-308
- Heinlein, C.A.¹ Chang, C.²

13
- 84863111874
- M. E. van Royen W. A. van Cappellen C. de Vos A. B. Houtsmuller J. Trapman J. Cell Sci. 2012 125 1970 1979
- (2012) J. Cell Sci. , vol.125 , pp. 1970-1979
- Van Royen, M.E.¹ Van Cappellen, W.A.² De Vos, C.³ Houtsmuller, A.B.⁴ Trapman, J.⁵

14
- 24044540381
- Q. Wang J. S. Carroll M. Brown Mol. Cell 2005 19 631 642
- (2005) Mol. Cell , vol.19 , pp. 631-642
- Wang, Q.¹ Carroll, J.S.² Brown, M.³

15
- 0036208492
- Y. Shang M. Myers M. Brown Mol. Cell 2002 9 601 610
- (2002) Mol. Cell , vol.9 , pp. 601-610
- Shang, Y.¹ Myers, M.² Brown, M.³

16
- 77957680915
- B. Liu L. Su J. Geng J. Liu G. Zhao ChemMedChem 2010 5 1651 1661
- (2010) ChemMedChem , vol.5 , pp. 1651-1661
- Liu, B.¹ Su, L.² Geng, J.³ Liu, J.⁴ Zhao, G.⁵

17
- 27844611242
- C. E. Bohl D. D. Miller J. Chen C. E. Bell J. T. Dalton J. Biol. Chem. 2005 280 37747 37754
- (2005) J. Biol. Chem. , vol.280 , pp. 37747-37754
- Bohl, C.E.¹ Miller, D.D.² Chen, J.³ Bell, C.E.⁴ Dalton, J.T.⁵

18
- 17844376217
- C. E. Bohl W. Gao D. D. Miller C. E. Bell J. T. Dalton Proc. Natl. Acad. Sci. U. S. A. 2005 102 6201 6206
- (2005) Proc. Natl. Acad. Sci. U. S. A. , vol.102 , pp. 6201-6206
- Bohl, C.E.¹ Gao, W.² Miller, D.D.³ Bell, C.E.⁴ Dalton, J.T.⁵

19
- 0026033434
- G. T. Kennealey B. J. Furr Urol. Clin. North Am. 1991 18 99 110
- (1991) Urol. Clin. North Am. , vol.18 , pp. 99-110
- Kennealey, G.T.¹ Furr, B.J.²

20
- 0030041490
- G. Blackledqe G. Kolvenbaq A. Nash Anticancer Drugs 1996 7 27 34
- (1996) Anticancer Drugs , vol.7 , pp. 27-34
- Blackledqe, G.¹ Kolvenbaq, G.² Nash, A.³

21
- 0032497522
- M. A. Eisenberger B. A. Blumenstein E. D. Crawford C. Miller D. G. Mcleod P. J. Loehrer G. Wilding K. Sears D. J. Culkin I. M. Thompson A. J. Bueschen B. A. Lowe N. Engl. J. Med. 1998 339 1036 1042
- (1998) N. Engl. J. Med. , vol.339 , pp. 1036-1042
- Eisenberger, M.A.¹ Blumenstein, B.A.² Crawford, E.D.³ Miller, C.⁴ Mcleod, D.G.⁵ Loehrer, P.J.⁶ Wilding, G.⁷ Sears, K.⁸ Culkin, D.J.⁹ Thompson, I.M.¹⁰ Bueschen, A.J.¹¹ Lowe, B.A.¹²

22
- 0026317752
- C. J. Tyrrell J. E. Altwein E. Varenhorst G. Lunqlmayr F. Boccardo I. M. Holdaway J. M. Haefliqer J. P. Jordaan J. Urol. 1991 146 1321 1326
- (1991) J. Urol. , vol.146 , pp. 1321-1326
- Tyrrell, C.J.¹ Altwein, J.E.² Varenhorst, E.³ Lunqlmayr, G.⁴ Boccardo, F.⁵ Holdaway, I.M.⁶ Haefliqer, J.M.⁷ Jordaan, J.P.⁸

23
- 33644675811
- H. I. Scher C. L. Sawyers J. Clin. Oncol. 2005 23 8253 8261
- (2005) J. Clin. Oncol. , vol.23 , pp. 8253-8261
- Scher, H.I.¹ Sawyers, C.L.²

24
- 0030265868
- E. R. Barrack Mt. Sinai J. Med. 1996 63 403 412
- (1996) Mt. Sinai J. Med. , vol.63 , pp. 403-412
- Barrack, E.R.¹

25
- 84885214146
- M. Korpal J. M. Korn D. P. Rakiec D. A. Ruddy S. Doshi J. Yuan S. G. Kovates S. Kim V. G. Cooke J. E. Monahan F. Steqmeier T. M. Roberts W. R. Sellers W. Zhou P. Zhu Cancer Discovery 2013 3 1030 1043
- (2013) Cancer Discovery , vol.3 , pp. 1030-1043
- Korpal, M.¹ Korn, J.M.² Rakiec, D.P.³ Ruddy, D.A.⁴ Doshi, S.⁵ Yuan, J.⁶ Kovates, S.G.⁷ Kim, S.⁸ Cooke, V.G.⁹ Monahan, J.E.¹⁰ Steqmeier, F.¹¹ Roberts, T.M.¹² Sellers, W.R.¹³ Zhou, W.¹⁴ Zhu, P.¹⁵

26
- 0037226103
- T. Hara J. Miyazaki H. Araki M. Yamaoka N. Kanzaki M. Kusaka M. Miyamoto Cancer Res. 2003 63 149 153
- (2003) Cancer Res. , vol.63 , pp. 149-153
- Hara, T.¹ Miyazaki, J.² Araki, H.³ Yamaoka, M.⁴ Kanzaki, N.⁵ Kusaka, M.⁶ Miyamoto, M.⁷

27
- 0036494196
- X. B. Shi A. H. Ma L. Xia H. J. Kung R. W. de Vere White Cancer Res. 2002 62 1496 1502
- (2002) Cancer Res. , vol.62 , pp. 1496-1502
- Shi, X.B.¹ Ma, A.H.² Xia, L.³ Kung, H.J.⁴ De Vere White, R.W.⁵

28
- 84865499206
- N. Nagata K. Kawai I. Nakanishi J. Chem. Inf. Model. 2012 52 2257 2264
- (2012) J. Chem. Inf. Model. , vol.52 , pp. 2257-2264
- Nagata, N.¹ Kawai, K.² Nakanishi, I.³

29
- 55949119492
- W. H. Bisson R. Abagyan C. N. Cavasotto J. Mol. Graphics Modell. 2008 27 452 458
- (2008) J. Mol. Graphics Modell. , vol.27 , pp. 452-458
- Bisson, W.H.¹ Abagyan, R.² Cavasotto, C.N.³

30
- 84859856923
- Accelrys Inc., CA
- Discovery Studio version 2.5, Accelrys Inc., CA, 2009
- (2009) Discovery Studio Version 2.5

31
- 0004074379
- Hypercube Inc. Publication
- HyperChem 7.0, Hypercube Inc. Publication, 2002
- (2002) HyperChem 7.0

32
- 0001041959
- A. Jakalian B. L. Bush D. B. Jack C. I. Bayly J. Comput. Chem. 2000 21 132 146
- (2000) J. Comput. Chem. , vol.21 , pp. 132-146
- Jakalian, A.¹ Bush, B.L.² Jack, D.B.³ Bayly, C.I.⁴

33
- 2942532422
- J. Wang R. M. Wolf J. M. Caldwell P. A. Kollman D. A. Case J. Comput. Chem. 2004 25 1157 1174
- (2004) J. Comput. Chem. , vol.25 , pp. 1157-1174
- Wang, J.¹ Wolf, R.M.² Caldwell, J.M.³ Kollman, P.A.⁴ Case, D.A.⁵

34
- 33748518255
- V. Hornak R. Abel A. Okur B. Strockbine Proteins 2006 65 712 725
- (2006) Proteins , vol.65 , pp. 712-725
- Hornak, V.¹ Abel, R.² Okur, A.³ Strockbine, B.⁴

35
- 84862614975
- University of California, San Francisco
- D. A. Case, T. A. Darden, T. E. Cheatham, III, C. L. Simmerling, J. Wang, R. E. Duke, R. Luo, R. C. Walker, W. Zhang, K. M. Merz, B. Roberts, S. Hayik, A. Roitberg, G. Seabra, J. Swails, A. W. Götz, I. Kolossváry, K. F. Wong, F. Paesani, J. Vanicek, R. M. Wolf, J. Liu, X. Wu, S. R. Brozell, T. Steinbrecher, H. Gohlke, Q. Cai, X. Ye, J. Wang, M. J. Hsieh, G. Cui, D. R. Roe, D. H. Mathews, M. G. Seetin, R. Salomon-Ferrer, C. Sagui, V. Babin, T. Luchko, S. Gusarov, A. Kovalenko and P. A. Kollman, AMBER 12, University of California, San Francisco, 2012
- (2012) AMBER 12
- Case, D.A.¹ Darden, T.A.² Cheatham, T.E.³ Simmerling, C.L.⁴ Wang, J.⁵ Duke, R.E.⁶ Luo, R.⁷ Walker, R.C.⁸ Zhang, W.⁹ Merz, K.M.¹⁰ Roberts, B.¹¹ Hayik, S.¹² Roitberg, A.¹³ Seabra, G.¹⁴ Swails, J.¹⁵ Götz, A.W.¹⁶ Kolossváry, I.¹⁷ Wong, K.F.¹⁸ Paesani, F.¹⁹ Vanicek, J.²⁰ more..

36
- 0004016501
- Comparison of simple potential functions for simulating liquid water
- W. L. Jorgensen J. Chandrasekhar J. D. Madura R. W. Iepey M. L. Klein Comparison of simple potential functions for simulating liquid water J. Chem. Phys. 1983 79 926 935
- (1983) J. Chem. Phys. , vol.79 , pp. 926-935
- Jorgensen, W.L.¹ Chandrasekhar, J.² Madura, J.D.³ Iepey, R.W.⁴ Klein, M.L.⁵

37
- 33645961739
- U. Essmann L. Perera M. L. Berkowitz T. Darden H. Lee L. G. Pedersen J. Chem. Phys. 1995 103 8577 8593
- (1995) J. Chem. Phys. , vol.103 , pp. 8577-8593
- Essmann, U.¹ Perera, L.² Berkowitz, M.L.³ Darden, T.⁴ Lee, H.⁵ Pedersen, L.G.⁶

38
- 33846823909
- T. Darden D. York L. Pedersen J. Chem. Phys. 1993 98 10089 10092
- (1993) J. Chem. Phys. , vol.98 , pp. 10089-10092
- Darden, T.¹ York, D.² Pedersen, L.³

39
- 33646940952
- J. P. Rychaert G. Ciccotti H. J. C. Berendsen J. Comput. Phys. 1977 23 327 341
- (1977) J. Comput. Phys. , vol.23 , pp. 327-341
- Rychaert, J.P.¹ Ciccotti, G.² Berendsen, H.J.C.³

40
- 84939942898
- M. Bello R. Campos-Rodriguez S. Rojas-Hernandez A. Contis-Montes de Oca J. Correa-Basurto Immunol. Res. 2015 62 3 15
- (2015) Immunol. Res. , vol.62 , pp. 3-15
- Bello, M.¹ Campos-Rodriguez, R.² Rojas-Hernandez, S.³ Contis-Montes De Oca, A.⁴ Correa-Basurto, J.⁵

41
- 84902274282
- M. Bello J. E. Mendieta-Wejebe J. Correa-Basurto Biochem. Pharmacol. 2014 90 145 158
- (2014) Biochem. Pharmacol. , vol.90 , pp. 145-158
- Bello, M.¹ Mendieta-Wejebe, J.E.² Correa-Basurto, J.³

42
- 79952588669
- T. Hou J. Wang Y. Li W. Wang J. Chem. Inf. Model. 2011 51 69 82
- (2011) J. Chem. Inf. Model. , vol.51 , pp. 69-82
- Hou, T.¹ Wang, J.² Li, Y.³ Wang, W.⁴

43
- 79951996670
- T. Hou J. Wang Y. Li W. Wang J. Comput. Chem. 2011 32 866 877
- (2011) J. Comput. Chem. , vol.32 , pp. 866-877
- Hou, T.¹ Wang, J.² Li, Y.³ Wang, W.⁴

44
- 84880541805
- L. Xu H. Sun Y. Li J. Wang T. Hou J. Phys. Chem. B 2013 117 8408 8421
- (2013) J. Phys. Chem. B , vol.117 , pp. 8408-8421
- Xu, L.¹ Sun, H.² Li, Y.³ Wang, J.⁴ Hou, T.⁵

45
- 84904438047
- H. Sun Y. Li S. Tian L. Xu T. Hou Phys. Chem. Chem. Phys. 2014 16 16719 16729
- (2014) Phys. Chem. Chem. Phys. , vol.16 , pp. 16719-16729
- Sun, H.¹ Li, Y.² Tian, S.³ Xu, L.⁴ Hou, T.⁵

46
- 84904604662
- M. Bello Biopolymers 2014 101 1010 1018
- (2014) Biopolymers , vol.101 , pp. 1010-1018
- Bello, M.¹

47
- 0043245780
- H. Gohlke C. Kiel D. A. Case J. Mol. Biol. 2003 330 891 913
- (2003) J. Mol. Biol. , vol.330 , pp. 891-913
- Gohlke, H.¹ Kiel, C.² Case, D.A.³

48
- 1842479952
- A. Onufriev D. Bashford D. A. Case Proteins 2004 55 383 394
- (2004) Proteins , vol.55 , pp. 383-394
- Onufriev, A.¹ Bashford, D.² Case, D.A.³

49
- 0034521981
- P. A. Kollman I. Massova C. Reyes B. Kuhn S. Huo L. Chong M. Lee Y. Duan W. Wang O. Donini P. Cieplak J. Srinivasan D. A. Case T. E. Cheatham Acc. Chem. Res. 2000 33 889 897
- (2000) Acc. Chem. Res. , vol.33 , pp. 889-897
- Kollman, P.A.¹ Massova, I.² Reyes, C.³ Kuhn, B.⁴ Huo, S.⁵ Chong, L.⁶ Lee, M.⁷ Duan, Y.⁸ Wang, W.⁹ Donini, O.¹⁰ Cieplak, P.¹¹ Srinivasan, J.¹² Case, D.A.¹³ Cheatham, T.E.¹⁴

50
- 0032560959
- J. Srinivasan T. E. Cheatham P. Cieplak P. A. Kollman D. A. Case J. Am. Chem. Soc. 1998 120 9401 9409
- (1998) J. Am. Chem. Soc. , vol.120 , pp. 9401-9409
- Srinivasan, J.¹ Cheatham, T.E.² Cieplak, P.³ Kollman, P.A.⁴ Case, D.A.⁵

51
- 84897584893
- P. Jiao W. Xue Y. Shen N. jin H. Liu Mol. BioSyst. 2014 10 767 777
- (2014) Mol. BioSyst. , vol.10 , pp. 767-777
- Jiao, P.¹ Xue, W.² Shen, Y.³ Jin, N.⁴ Liu, H.⁵

52
- 32844457567
- D. Sitkoff K. A. Sharp B. Honig J. Phys. Chem. 1994 98 1978 1988
- (1994) J. Phys. Chem. , vol.98 , pp. 1978-1988
- Sitkoff, D.¹ Sharp, K.A.² Honig, B.³

53
- 39049111013
- T. Hou W. Zhang D. A. Case W. Wang J. Mol. Biol. 2008 376 1201 1214
- (2008) J. Mol. Biol. , vol.376 , pp. 1201-1214
- Hou, T.¹ Zhang, W.² Case, D.A.³ Wang, W.⁴

54
- 84860635411
- T. Hou N. Li Y. Li W. Wang J. Proteome Res. 2012 11 2982 2995
- (2012) J. Proteome Res. , vol.11 , pp. 2982-2995
- Hou, T.¹ Li, N.² Li, Y.³ Wang, W.⁴

55
- 84863653124
- W. Xue J. Qi Y. Yang X. Jin H. Liu X. Yao Mol. BioSyst. 2012 8 2135 2144
- (2012) Mol. BioSyst. , vol.8 , pp. 2135-2144
- Xue, W.¹ Qi, J.² Yang, Y.³ Jin, X.⁴ Liu, H.⁵ Yao, X.⁶

56
- 84920394601
- M. H. Tan J. Li K. Mlcher E. L. Yong Acta Pharmacol. Sin. 2014 1 3 23
- (2014) Acta Pharmacol. Sin. , vol.1 , pp. 3-23
- Tan, M.H.¹ Li, J.² Mlcher, K.³ Yong, E.L.⁴

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