-
1
-
-
9244257348
-
Rho-associated kinase, a novel serine/threonine kinase, as a putative target for small GTP binding protein Rho
-
T. Matsui M. Amano T. Yamamoto K. Chihara M. Nakafuku M. Ito T. Nakano K. Okawa A. Iwamatsu K. Kaibuchi Rho-associated kinase, a novel serine/threonine kinase, as a putative target for small GTP binding protein Rho EMBO J. 1996 15 2208 2216
-
(1996)
EMBO J.
, vol.15
, pp. 2208-2216
-
-
Matsui, T.1
Amano, M.2
Yamamoto, T.3
Chihara, K.4
Nakafuku, M.5
Ito, M.6
Nakano, T.7
Okawa, K.8
Iwamatsu, A.9
Kaibuchi, K.10
-
2
-
-
0028863142
-
A novel serine/threonine kinase binding the Ras-related RhoA GTPase which translocates the kinase to peripheral membranes
-
T. Leung E. Manser L. Tan L. Lim A novel serine/threonine kinase binding the Ras-related RhoA GTPase which translocates the kinase to peripheral membranes J. Biol. Chem. 1995 270 29051 29054
-
(1995)
J. Biol. Chem.
, vol.270
, pp. 29051-29054
-
-
Leung, T.1
Manser, E.2
Tan, L.3
Lim, L.4
-
3
-
-
0030603119
-
ROCK-I and ROCK-II, two isoforms of Rho-associated coiled-coil forming protein serine/threonine kinase in mice
-
O. Nakagawa K. Fujisawa T. Ishizaki Y. Saito K. Nakao S. Narumiya ROCK-I and ROCK-II, two isoforms of Rho-associated coiled-coil forming protein serine/threonine kinase in mice FEBS Lett. 1996 392 189 193
-
(1996)
FEBS Lett.
, vol.392
, pp. 189-193
-
-
Nakagawa, O.1
Fujisawa, K.2
Ishizaki, T.3
Saito, Y.4
Nakao, K.5
Narumiya, S.6
-
4
-
-
41749091574
-
Applications for ROCK kinase inhibition
-
M. F. Olson Applications for ROCK kinase inhibition Curr. Opin. Cell Biol. 2008 20 242 248
-
(2008)
Curr. Opin. Cell Biol.
, vol.20
, pp. 242-248
-
-
Olson, M.F.1
-
6
-
-
18944372230
-
Rho kinase, a promising drug target for neurological disorders
-
B. K. Mueller H. Mack N. Teusch Rho kinase, a promising drug target for neurological disorders Nat. Rev. Drug Discovery 2005 4 387 398
-
(2005)
Nat. Rev. Drug Discovery
, vol.4
, pp. 387-398
-
-
Mueller, B.K.1
MacK, H.2
Teusch, N.3
-
7
-
-
34948841930
-
Rho/Rho kinase is a key enzyme system involved in the angiotensin II signaling pathway of liver fibrosis and steatosis
-
K. Kitamura S. Tada N. Nakamoto K. Toda H. Horikawa S. Kurita S. Tsunematsu N. Kumagai H. Ishii H. Saito Rho/Rho kinase is a key enzyme system involved in the angiotensin II signaling pathway of liver fibrosis and steatosis J. Gastroenterol. Hepatol. 2007 22 2022 2033
-
(2007)
J. Gastroenterol. Hepatol.
, vol.22
, pp. 2022-2033
-
-
Kitamura, K.1
Tada, S.2
Nakamoto, N.3
Toda, K.4
Horikawa, H.5
Kurita, S.6
Tsunematsu, S.7
Kumagai, N.8
Ishii, H.9
Saito, H.10
-
9
-
-
3242699514
-
Overexpression of RhoA, Rac1, and Cdc42 GTPases is associated with progression in testicular cancer
-
T. Kamai T. Yamanishi H. Shirataki K. Takagi H. Asami Y. Ito K. I. Yoshida Overexpression of RhoA, Rac1, and Cdc42 GTPases is associated with progression in testicular cancer Clin. Cancer Res. 2004 10 4799 4805
-
(2004)
Clin. Cancer Res.
, vol.10
, pp. 4799-4805
-
-
Kamai, T.1
Yamanishi, T.2
Shirataki, H.3
Takagi, K.4
Asami, H.5
Ito, Y.6
Yoshida, K.I.7
-
10
-
-
0043160105
-
Overexpression of ROCK in human breast cancer cells: Evidence that ROCK activity mediates intracellular membrane traffic of lysosomes
-
Y. Nishimura K. Itoh K. Yoshioka K. Tokuda M. Himeno Overexpression of ROCK in human breast cancer cells: evidence that ROCK activity mediates intracellular membrane traffic of lysosomes Pathol. Oncol. Res. 2003 9 83 95
-
(2003)
Pathol. Oncol. Res.
, vol.9
, pp. 83-95
-
-
Nishimura, Y.1
Itoh, K.2
Yoshioka, K.3
Tokuda, K.4
Himeno, M.5
-
12
-
-
66149095045
-
Rho-kinase 2 is frequently overexpressed in hepatocellular carcinoma and involved in tumor invasion
-
C. C. L. Wong C. M. Wong E. K. K. Tung K. Man I. O. L. Ng Rho-kinase 2 is frequently overexpressed in hepatocellular carcinoma and involved in tumor invasion Hepatology 2009 49 1583 1594
-
(2009)
Hepatology
, vol.49
, pp. 1583-1594
-
-
Wong, C.C.L.1
Wong, C.M.2
Tung, E.K.K.3
Man, K.4
Ng, I.O.L.5
-
14
-
-
0034017744
-
Pharmacological properties of Y-27632, a specific inhibitor of Rho-associated kinases
-
T. Ishizaki M. Uehata I. Tamechika J. Keel K. Nonomura M. Maekawa S. Narumiya Pharmacological properties of Y-27632, a specific inhibitor of Rho-associated kinases Mol. Pharmacol. 2000 57 976 983
-
(2000)
Mol. Pharmacol.
, vol.57
, pp. 976-983
-
-
Ishizaki, T.1
Uehata, M.2
Tamechika, I.3
Keel, J.4
Nonomura, K.5
Maekawa, M.6
Narumiya, S.7
-
15
-
-
70349235617
-
Pharmacological characterization of SAR407899, a novel Rho-kinase inhibitor
-
M. Lohn O. Plettenburg Y. Ivashchenko A. Kannt A. Hofmeister D. Kadereit M. Schaefer W. Linz M. Kohlmann J. M. Herbert Pharmacological characterization of SAR407899, a novel Rho-kinase inhibitor Hypertension 2009 54 676 683
-
(2009)
Hypertension
, vol.54
, pp. 676-683
-
-
Lohn, M.1
Plettenburg, O.2
Ivashchenko, Y.3
Kannt, A.4
Hofmeister, A.5
Kadereit, D.6
Schaefer, M.7
Linz, W.8
Kohlmann, M.9
Herbert, J.M.10
-
16
-
-
80054998108
-
Ocular Hypotensive Effect of the Rho kinase Inhibitor AR-12286 in Patients with Glaucoma and Ocular Hypertension
-
R. D. Williams G. D. Novack T. Van Haarlem C. Kopczynski Ocular Hypotensive Effect of the Rho kinase Inhibitor AR-12286 in Patients With Glaucoma and Ocular Hypertension Am. J. Ophthalmol. 2011 152 834 841
-
(2011)
Am. J. Ophthalmol.
, vol.152
, pp. 834-841
-
-
Williams, R.D.1
Novack, G.D.2
Van Haarlem, T.3
Kopczynski, C.4
-
18
-
-
33646577132
-
Targeting Rho to stimulate repair after spinal cord injury
-
L. McKerracher H. Higuchi Targeting Rho to stimulate repair after spinal cord injury J. Neurotrauma 2006 23 309 317
-
(2006)
J. Neurotrauma
, vol.23
, pp. 309-317
-
-
McKerracher, L.1
Higuchi, H.2
-
19
-
-
34249301303
-
Development of Rho-kinase inhibitors for cardiovascular medicine
-
H. Shimokawa M. Rashid Development of Rho-kinase inhibitors for cardiovascular medicine Trends Pharmacol. Sci. 2007 28 296 302
-
(2007)
Trends Pharmacol. Sci.
, vol.28
, pp. 296-302
-
-
Shimokawa, H.1
Rashid, M.2
-
21
-
-
77954349369
-
Molecular modeling studies of Rho kinase inhibitors using molecular docking and 3D-QSAR analysis
-
J. Qin B. Lei L. Xi H. Liu X. Yao Molecular modeling studies of Rho kinase inhibitors using molecular docking and 3D-QSAR analysis Eur. J. Med. Chem. 2010 45 2768 2776
-
(2010)
Eur. J. Med. Chem.
, vol.45
, pp. 2768-2776
-
-
Qin, J.1
Lei, B.2
Xi, L.3
Liu, H.4
Yao, X.5
-
22
-
-
53249144547
-
A molecular mechanism of P-loop pliability of Rho-kinase investigated by molecular dynamic simulation
-
K. Gohda T. Hakoshima A molecular mechanism of P-loop pliability of Rho-kinase investigated by molecular dynamic simulation J. Comput.-Aided Mol. Des. 2008 22 789 797
-
(2008)
J. Comput.-Aided Mol. Des.
, vol.22
, pp. 789-797
-
-
Gohda, K.1
Hakoshima, T.2
-
23
-
-
1642350394
-
Recent development and application of virtual screening in drug discovery: An overview
-
T. J. Hou X. J. Xu Recent development and application of virtual screening in drug discovery: An overview Curr. Pharm. Des. 2004 10 1011 1033
-
(2004)
Curr. Pharm. Des.
, vol.10
, pp. 1011-1033
-
-
Hou, T.J.1
Xu, X.J.2
-
24
-
-
0000635548
-
Rational screening set design and compound selection: Cascaded clustering
-
P. R. Menard R. A. Lewis J. S. Mason Rational screening set design and compound selection: cascaded clustering J. Chem. Inf. Model. 1998 38 497 505
-
(1998)
J. Chem. Inf. Model.
, vol.38
, pp. 497-505
-
-
Menard, P.R.1
Lewis, R.A.2
Mason, J.S.3
-
26
-
-
79960189765
-
Design and Synthesis of Small Molecule RhoA Inhibitors: A New Promising Therapy for Cardiovascular Diseases?
-
J. Deng E. G. Feng S. Ma Y. Zhang X. F. Liu H. L. Li H. Huang J. Zhu W. L. Zhu X. Shen L. Y. Miao H. Liu H. L. Jiang J. Li Design and Synthesis of Small Molecule RhoA Inhibitors: A New Promising Therapy for Cardiovascular Diseases? J. Med. Chem. 2011 54 4508 4522
-
(2011)
J. Med. Chem.
, vol.54
, pp. 4508-4522
-
-
Deng, J.1
Feng, E.G.2
Ma, S.3
Zhang, Y.4
Liu, X.F.5
Li, H.L.6
Huang, H.7
Zhu, J.8
Zhu, W.L.9
Shen, X.10
Miao, L.Y.11
Liu, H.12
Jiang, H.L.13
Li, J.14
-
27
-
-
23444447457
-
Discovery of Cell-Permeable Non-Peptide Inhibitors of beta-Secretase by High-Throughput Docking and Continuum Electrostatics Calculations
-
D. Huang U. Luthi P. Kolb K. Edler M. Cecchini S. Audetat A. Barberis A. Caflisch Discovery of Cell-Permeable Non-Peptide Inhibitors of beta-Secretase by High-Throughput Docking and Continuum Electrostatics Calculations J. Med. Chem. 2005 48 5108 5111
-
(2005)
J. Med. Chem.
, vol.48
, pp. 5108-5111
-
-
Huang, D.1
Luthi, U.2
Kolb, P.3
Edler, K.4
Cecchini, M.5
Audetat, S.6
Barberis, A.7
Caflisch, A.8
-
28
-
-
65549122954
-
Discovery of a Non-Peptidic Inhibitor of West Nile Virus NS3 Protease by High-Throughput Docking
-
D. Ekonomiuk X.-C. Su K. Ozawa C. Bodenreider S. P. Lim Z. Yin T. H. Keller D. Beer V. Patel G. Otting A. Caflisch D. Huang Discovery of a Non-Peptidic Inhibitor of West Nile Virus NS3 Protease by High-Throughput Docking PLoS Neglected Trop. Dis. 2009 3 e356
-
(2009)
PLoS Neglected Trop. Dis.
, vol.3
, pp. 356
-
-
Ekonomiuk, D.1
Su, X.-C.2
Ozawa, K.3
Bodenreider, C.4
Lim, S.P.5
Yin, Z.6
Keller, T.H.7
Beer, D.8
Patel, V.9
Otting, G.10
Caflisch, A.11
Huang, D.12
-
29
-
-
41649096077
-
Discovery of kinase Inhibitors by High-Throughput Docking and Scoring Based on a Transferable Linear Interaction Energy Model
-
P. Kolb D. Huang F. Dey A. Caflisch Discovery of kinase Inhibitors by High-Throughput Docking and Scoring Based on a Transferable Linear Interaction Energy Model J. Med. Chem. 2008 51 1179 1188
-
(2008)
J. Med. Chem.
, vol.51
, pp. 1179-1188
-
-
Kolb, P.1
Huang, D.2
Dey, F.3
Caflisch, A.4
-
31
-
-
77955659783
-
-
Version 9.0, Schrödinger, LLC, New York, NY
-
Schrödinger, version 9.0, Schrödinger, LLC, New York, NY, 2009
-
(2009)
Schrödinger
-
-
-
32
-
-
0035913529
-
Evaluation and reparametrization of the OPLS-AA force field for proteins via comparison with accurate quantum chemical calculations on peptides
-
G. A. Kaminski R. A. Friesner J. Tirado-Rives W. L. Jorgensen Evaluation and reparametrization of the OPLS-AA force field for proteins via comparison with accurate quantum chemical calculations on peptides J. Phys. Chem. B 2001 105 6474 6487
-
(2001)
J. Phys. Chem. B
, vol.105
, pp. 6474-6487
-
-
Kaminski, G.A.1
Friesner, R.A.2
Tirado-Rives, J.3
Jorgensen, W.L.4
-
33
-
-
33846108633
-
BindingDB: A web-accessible database of experimentally determined protein-ligand binding affinities
-
T. Liu Y. Lin X. Wen R. N. Jorissen M. K. Gilson BindingDB: a web-accessible database of experimentally determined protein-ligand binding affinities Nucleic Acids Res. 2007 35 D198 D201
-
(2007)
Nucleic Acids Res.
, vol.35
-
-
Liu, T.1
Lin, Y.2
Wen, X.3
Jorissen, R.N.4
Gilson, M.K.5
-
34
-
-
84860626102
-
-
Accelrys Inc., San Diego
-
Discovery Studio 2.5 Guide, Accelrys Inc., San Diego, http://www.accelrys.com, 2009
-
(2009)
Discovery Studio 2.5 Guide
-
-
-
36
-
-
33748518255
-
Comparison of multiple Amber force fields and development of improved protein backbone parameters
-
V. Hornak R. Abel A. Okur B. Strockbine A. Roitberg C. Simmerling Comparison of multiple Amber force fields and development of improved protein backbone parameters Proteins: Struct., Funct., Bioinf. 2006 65 712 725
-
(2006)
Proteins: Struct., Funct., Bioinf.
, vol.65
, pp. 712-725
-
-
Hornak, V.1
Abel, R.2
Okur, A.3
Strockbine, B.4
Roitberg, A.5
Simmerling, C.6
-
37
-
-
0038626673
-
-
Gaussian Inc., Wallingford, CT
-
M. J. Frisch, G. W. Trucks, H. B. Schlegel, G. E. Scuseria, M. A. Robb, J. R. Cheeseman, J. A. J. Montgomery, T. Vreven, K. N. Kudin, J. C. Burant, J. M. Millam, S. S. Lyengar, J. Tomasi, V. Barone, B. Mennucci, M. Cossi, G. Scalmani, N. Rega, G. A. Petersson, H. Nakatsuji, M. Hada, M. Ehara, K. Toyota, R. Fukuda, J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, M. Klene, X. Li, J. E. Knox, H. P. Hratchian, J. B. Cross, B. Bakken, C. Adamo, J. Jaramillo, R. Gomperts, R. E. Stratmann, O. Yazyev, A. J. Austin, R. Cammi, C. Pomelli, J. W. Ochterski, P. Y. Ayala, K. Morokuma, G. A. Voth, P. Salvador, J. J. Dannenberg, V. G. Zakrzewski, S. Dapprich, A. D. Daniels, M. C. Strain, O. Farkas, D. K. Malick, A. D. Rabuck, K. Raghavachari, J. B. Foresman, J. V. Ortiz, Q. Cui, A. G. Baboul, S. Clifford, J. Cioslowski, B. B. Stefanov, A. Liashenko, A. Liashenko, P. Piskorz, I. Komaromi, R. L. Martin, D. J. FOx, T. Keith, M. A. Al-Laham, C. Y. Peng, A. Nanayakkara, M. Challacombe, P. M. W. Gill, B. Johnson, W. Chen, M. W. Wong, C. Gonzalez and J. A. Pople, Gaussian 03, Gaussian Inc., Wallingford, CT, 2004
-
(2004)
Gaussian 03
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Scuseria, G.E.4
Robb, M.A.5
Cheeseman, J.R.6
Montgomery, J.A.J.7
Vreven, T.8
Kudin, K.N.9
Burant, J.C.10
Millam, J.M.11
Lyengar, S.S.12
Tomasi, J.13
Barone, V.14
Mennucci, B.15
Cossi, M.16
Scalmani, G.17
Rega, N.18
Petersson, G.A.19
Nakatsuji, H.20
Hada, M.21
Ehara, M.22
Toyota, K.23
Fukuda, R.24
Hasegawa, J.25
Ishida, M.26
Nakajima, T.27
Honda, Y.28
Kitao, O.29
Nakai, H.30
Klene, M.31
Li, X.32
Knox, J.E.33
Hratchian, H.P.34
Cross, J.B.35
Bakken, B.36
Adamo, C.37
Jaramillo, J.38
Gomperts, R.39
Stratmann, R.E.40
Yazyev, O.41
Austin, A.J.42
Cammi, R.43
Pomelli, C.44
Ochterski, J.W.45
Ayala, P.Y.46
Morokuma, K.47
Voth, G.A.48
Salvador, P.49
Dannenberg, J.J.50
Zakrzewski, V.G.51
Dapprich, S.52
Daniels, A.D.53
Strain, M.C.54
Farkas, O.55
Malick, D.K.56
Rabuck, A.D.57
Raghavachari, K.58
Foresman, J.B.59
Ortiz, J.V.60
Cui, Q.61
Baboul, A.G.62
Clifford, S.63
Cioslowski, J.64
Stefanov, B.B.65
Liashenko, A.66
Liashenko, A.67
Piskorz, P.68
Komaromi, I.69
Martin, R.L.70
Fox, D.J.71
Keith, T.72
Al-Laham, M.A.73
Peng, C.Y.74
Nanayakkara, A.75
Challacombe, M.76
Gill, P.M.W.77
Johnson, B.78
Chen, W.79
Wong, M.W.80
Gonzalez, C.81
Pople, J.A.82
more..
-
38
-
-
3042524904
-
A Well-Behaved Electrostatic Potential Based Method Using Charge Restraints for Deriving Atomic Charges - The Resp Model
-
C. I. Bayly P. Cieplak W. D. Cornell P. A. Kollman A Well-Behaved Electrostatic Potential Based Method Using Charge Restraints for Deriving Atomic Charges-the Resp Model J. Phys. Chem. 1993 97 10269 10280
-
(1993)
J. Phys. Chem.
, vol.97
, pp. 10269-10280
-
-
Bayly, C.I.1
Cieplak, P.2
Cornell, W.D.3
Kollman, P.A.4
-
40
-
-
33846823909
-
Particle Mesh Ewald-an N·log(N) Method for Ewald Sums in Large Systems
-
T. Darden D. York L. Pedersen Particle Mesh Ewald-an N·log(N) Method for Ewald Sums in Large Systems 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
-
41
-
-
33646940952
-
Numerical integration of the Cartesian equations of motion of a system with constraints: Molecular dynamics of n-alkanes
-
J. P. Ryckaert G. Ciccotti H. J. C. Berendsen Numerical integration of the Cartesian equations of motion of a system with constraints: molecular dynamics of n-alkanes J. Comput. Phys. 1977 23 327 341
-
(1977)
J. Comput. Phys.
, vol.23
, pp. 327-341
-
-
Ryckaert, J.P.1
Ciccotti, G.2
Berendsen, H.J.C.3
-
42
-
-
23444454552
-
The Amber biomolecular simulation programs
-
D. A. Case T. E. Cheatham T. Darden H. Gohlke R. Luo K. M. Merz A. Onufriev C. Simmerling B. Wang R. J. Woods The Amber biomolecular simulation programs J. Comput. Chem. 2005 26 1668 1688
-
(2005)
J. Comput. Chem.
, vol.26
, pp. 1668-1688
-
-
Case, D.A.1
Cheatham, T.E.2
Darden, T.3
Gohlke, H.4
Luo, R.5
Merz, K.M.6
Onufriev, A.7
Simmerling, C.8
Wang, B.9
Woods, R.J.10
-
43
-
-
66149146342
-
Characterization of Domain-Peptide Interaction Interface: A generic structure-based model to decipher the binding specificity of SH3 domains
-
T. J. Hou Z. Xu W. Zhang W. A. McLaughlin D. A. Case Y. Xu W. Wang Characterization of Domain-Peptide Interaction Interface: a generic structure-based model to decipher the binding specificity of SH3 domains Mol. Cell. Proteomics 2009 8 639 649
-
(2009)
Mol. Cell. Proteomics
, vol.8
, pp. 639-649
-
-
Hou, T.J.1
Xu, Z.2
Zhang, W.3
McLaughlin, W.A.4
Case, D.A.5
Xu, Y.6
Wang, W.7
-
44
-
-
39049111013
-
Characterization of domain-peptide interaction interface: A case study on the amphiphysin-1 SH3 domain
-
T. J. Hou W. Zhang D. A. Case W. Wang Characterization of domain-peptide interaction interface: A case study on the amphiphysin-1 SH3 domain J. Mol. Biol. 2008 376 1201 1214
-
(2008)
J. Mol. Biol.
, vol.376
, pp. 1201-1214
-
-
Hou, T.J.1
Zhang, W.2
Case, D.A.3
Wang, W.4
-
45
-
-
0043245780
-
Insights into protein-protein binding by binding free energy calculation and free energy decomposition for the Ras-Raf and Ras-RaIGDS complexes
-
H. Gohlke C. Kiel D. A. Case Insights into protein-protein binding by binding free energy calculation and free energy decomposition for the Ras-Raf and Ras-RaIGDS complexes 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
-
46
-
-
84860635411
-
Characterization of Domain-peptide Interaction Interface: Prediction of SH3 Domain-Mediated Protein-protein Interaction Network in Yeast by Generic Structure-Based Models
-
T. Hou N. Li Y. Li W. Wang Characterization of Domain-peptide Interaction Interface: Prediction of SH3 Domain-Mediated Protein-protein Interaction Network in Yeast by Generic Structure-Based Models 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
-
48
-
-
79952588669
-
Assessing the performance of the MM/PBSA and MM/GBSA methods. 1. The accuracy of binding free energy calculations based on molecular dynamics simulations
-
T. Hou J. Wang Y. Li W. Wang Assessing the performance of the MM/PBSA and MM/GBSA methods. 1. The accuracy of binding free energy calculations based on molecular dynamics simulations 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
-
49
-
-
79951996670
-
Assessing the performance of the molecular mechanics/Poisson Boltzmann surface area and molecular mechanics/generalized Born surface area methods. II. The accuracy of ranking poses generated from docking
-
T. Hou J. Wang Y. Li W. Wang Assessing the performance of the molecular mechanics/Poisson Boltzmann surface area and molecular mechanics/generalized Born surface area methods. II. The accuracy of ranking poses generated from docking 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
-
50
-
-
61449101624
-
Predicting drug resistance of the HIV-1 protease using molecular interaction energy components
-
T. Hou W. Zhang J. Wang W. Wang Predicting drug resistance of the HIV-1 protease using molecular interaction energy components Proteins: Struct., Funct., Bioinf. 2009 74 837 846
-
(2009)
Proteins: Struct., Funct., Bioinf.
, vol.74
, pp. 837-846
-
-
Hou, T.1
Zhang, W.2
Wang, J.3
Wang, W.4
-
51
-
-
79959405623
-
Prediction of peptides binding to the PKA RII alpha subunit using a hierarchical strategy
-
T. J. Hou Y. Y. Li W. Wang Prediction of peptides binding to the PKA RII alpha subunit using a hierarchical strategy Bioinformatics 2011 27 1814 1821
-
(2011)
Bioinformatics
, vol.27
, pp. 1814-1821
-
-
Hou, T.J.1
Li, Y.Y.2
Wang, W.3
-
52
-
-
20644449471
-
Modification of the generalized Born model suitable for macromolecules
-
A. Onufriev D. Bashford A. David Modification of the generalized Born model suitable for macromolecules J. Phys. Chem. B 2000 104 3712 3720
-
(2000)
J. Phys. Chem. B
, vol.104
, pp. 3712-3720
-
-
Onufriev, A.1
Bashford, D.2
David, A.3
-
53
-
-
0033772834
-
Use and properties of ROCK-specific inhibitor Y-27632
-
S. Narumiya T. Ishizaki M. Ufhata Use and properties of ROCK-specific inhibitor Y-27632 Methods Enzymol. 2000 325 273 284
-
(2000)
Methods Enzymol.
, vol.325
, pp. 273-284
-
-
Narumiya, S.1
Ishizaki, T.2
Ufhata, M.3
-
54
-
-
78650513427
-
Fragment-based discovery of 6-substituted isoquinolin-1-amine based ROCK-I inhibitors
-
P. Ray J. Wright J. Adam J. Bennett S. Boucharens D. Black A. Cook A. R. Brown O. Epemolu D. Fletcher Fragment-based discovery of 6-substituted isoquinolin-1-amine based ROCK-I inhibitors Bioorg. Med. Chem. Lett. 2011 21 97 101
-
(2011)
Bioorg. Med. Chem. Lett.
, vol.21
, pp. 97-101
-
-
Ray, P.1
Wright, J.2
Adam, J.3
Bennett, J.4
Boucharens, S.5
Black, D.6
Cook, A.7
Brown, A.R.8
Epemolu, O.9
Fletcher, D.10
-
55
-
-
33846246321
-
Discovery of aminofurazan-azabenzimidazoles as inhibitors of Rho-kinase with high kinase selectivity and antihypertensive activity
-
R. A. Stavenger H. Cui S. E. Dowdell R. G. Franz D. E. Gaitanopoulos K. B. Goodman M. A. Hilfiker L. Robert J. D. Leber J. P. Marino Jr Discovery of aminofurazan-azabenzimidazoles as inhibitors of Rho-kinase with high kinase selectivity and antihypertensive activity J. Med. Chem. 2007 50 2 5
-
(2007)
J. Med. Chem.
, vol.50
, pp. 2-5
-
-
Stavenger, R.A.1
Cui, H.2
Dowdell, S.E.3
Franz, R.G.4
Gaitanopoulos, D.E.5
Goodman, K.B.6
Hilfiker, M.A.7
Robert, L.8
Leber, J.D.9
Marino Jr., J.P.10
-
56
-
-
84877759580
-
-
Advanced Chemistry Development Inc., Toronto, Canada
-
ACD/ADME Suite 5.0, Advanced Chemistry Development Inc., Toronto, Canada, 2011
-
(2011)
ACD/ADME Suite 5.0
-
-
|