-
1
-
-
0013074820
-
A major outbreak of severe acute respiratory syndrome in Hong Kong
-
Lee, N.; Hui, D.; Wu, A.; Chan, P.; Cameron, P.; Joynt, G. M.; Ahuja, A.; Yung, M. Y.; Leung, C. B.; To, K. F.; Lui, S. F.; Szeto, C. C.; Chung, S.; Sung, J. J. A major outbreak of severe acute respiratory syndrome in Hong Kong. N. Engl. J. Med. 2003, 348, 1986-94.
-
(2003)
N. Engl. J. Med.
, vol.348
, pp. 1986-1994
-
-
Lee, N.1
Hui, D.2
Wu, A.3
Chan, P.4
Cameron, P.5
Joynt, G.M.6
Ahuja, A.7
Yung, M.Y.8
Leung, C.B.9
To, K.F.10
Lui, S.F.11
Szeto, C.C.12
Chung, S.13
Sung, J.J.14
-
2
-
-
0013165966
-
Identification of severe acute respiratory syndrome in Canada
-
Poutanen, S. M.; Low, D. E.; Henry, B.; Finkelstein, S.; Rose, D.; Green, K.; Tellier, R.; Draker, R.; Adachi, D.; Ayers, M.; Chan, A. K.; Skowronski, D. M.; Salit, I.; Simor, A. E.; Slutsky, A. S.; Doyle, P. W.; Krajden, M.; Petric, M.; Brunham, R. C.; McGeer, A. J. Identification of severe acute respiratory syndrome in Canada. N. Engl. J. Med. 2003, 348, 1995-2005.
-
(2003)
N. Engl. J. Med.
, vol.348
, pp. 1995-2005
-
-
Poutanen, S.M.1
Low, D.E.2
Henry, B.3
Finkelstein, S.4
Rose, D.5
Green, K.6
Tellier, R.7
Draker, R.8
Adachi, D.9
Ayers, M.10
Chan, A.K.11
Skowronski, D.M.12
Salit, I.13
Simor, A.E.14
Slutsky, A.S.15
Doyle, P.W.16
Krajden, M.17
Petric, M.18
Brunham, R.C.19
McGeer, A.J.20
more..
-
3
-
-
0038326554
-
SARS-associated coronavirus
-
Holmes, K. V. SARS-associated coronavirus. N. Engl. J. Med. 2003, 348, 1948-1951.
-
(2003)
N. Engl. J. Med.
, vol.348
, pp. 1948-1951
-
-
Holmes, K.V.1
-
4
-
-
0348198434
-
A novel coronavirus and SARS
-
Leng, Q.; Bentwich. Z. A novel coronavirus and SARS. N. Engl. J. Med. 2003. 349, 709.
-
(2003)
N. Engl. J. Med.
, vol.349
, pp. 709
-
-
Leng, Q.1
Bentwich, Z.2
-
5
-
-
0037561920
-
Characterization of a novel coronavirus associated with severe acute respiratory syndrome
-
Rota, P. A.; Oberste, M. S.; Monroe, S. S.; Nix, W. A.; Campagnoli, R.; Icenogle, J. P.; Penaranda, S.; Bankamp, B.; Maher, K.; Chen, M. H.; Tong, S.; Tamin, A.; Lowe, L.; Frace, M.; DeRisi, J. L.; Chen, Q.; Wang, D.; Erdman, D. D.; Peret, T. C.; Burns, C.; Ksiazek, T. G.; Rollin, P. E.; Sanchez, A.; Liffick, S.; Holloway, B.; Limor, J.; McCaustland, K.; Olsen-Rasmussen, M.; Fouchier, R.; Gunther, S.; Osterhaus, A. D.; Drosten, C.; Pallansch, M. A.; Anderson, L. J.; Bellini, W. J. Characterization of a novel coronavirus associated with severe acute respiratory syndrome. Science 2003, 300, 1394-1399.
-
(2003)
Science
, vol.300
, pp. 1394-1399
-
-
Rota, P.A.1
Oberste, M.S.2
Monroe, S.S.3
Nix, W.A.4
Campagnoli, R.5
Icenogle, J.P.6
Penaranda, S.7
Bankamp, B.8
Maher, K.9
Chen, M.H.10
Tong, S.11
Tamin, A.12
Lowe, L.13
Frace, M.14
DeRisi, J.L.15
Chen, Q.16
Wang, D.17
Erdman, D.D.18
Peret, T.C.19
Burns, C.20
Ksiazek, T.G.21
Rollin, P.E.22
Sanchez, A.23
Liffick, S.24
Holloway, B.25
Limor, J.26
McCaustland, K.27
Olsen-Rasmussen, M.28
Fouchier, R.29
Gunther, S.30
Osterhaus, A.D.31
Drosten, C.32
Pallansch, M.A.33
Anderson, L.J.34
Bellini, W.J.35
more..
-
6
-
-
0038823524
-
The Genome sequence of the SARS-associated coronavirus
-
Marra, M. A.; Jones, S. J.; Astell, C. R.; Holt, R. A.; Brooks-Wilson, A.; Butterfield, Y. S.; Khattra, J.; Asano, J. K.; Barber, S. A.; Chan, S. Y.; Cloutier, A.; Coughlin, S. M.; Freeman, D.; Girn, N.; Griffith, O. L.; Leach, S. R.; Mayo, M.; McDonald, H.; Montgomery, S. B.; Pandoh, P. K.; Petrescu, A. S.; Robertson, A. G.; Schein, J. E.; Siddiqui, A.; Smailus, D. E.; Stott, J. M.; Yang, G. S.; Plummer, F.; Andonov, A.; Artsob, H.; Bastien, N.; Bernard, K.; Booth, T. F.; Bowness, D.; Czub, M.; Drebot, M.; Fernando, L.; Flick, R.; Garbutt, M.; Gray, M.; Grolla, A.; Jones, S.; Feldmann, H.; Meyers, A.; Kabani, A.; Li, Y.; Normand, S.; Stroher, U.; Tipples, G. A.; Tyler, S.; Vogrig, R.; Ward, D.; Watson, B.; Brunham, R. C.; Krajden, M.; Petric, M.; Skowronski, D. M.; Upton, C.; Roper, R. L. The Genome sequence of the SARS-associated coronavirus. Science 2003, 300, 1399-1404.
-
(2003)
Science
, vol.300
, pp. 1399-1404
-
-
Marra, M.A.1
Jones, S.J.2
Astell, C.R.3
Holt, R.A.4
Brooks-Wilson, A.5
Butterfield, Y.S.6
Khattra, J.7
Asano, J.K.8
Barber, S.A.9
Chan, S.Y.10
Cloutier, A.11
Coughlin, S.M.12
Freeman, D.13
Girn, N.14
Griffith, O.L.15
Leach, S.R.16
Mayo, M.17
McDonald, H.18
Montgomery, S.B.19
Pandoh, P.K.20
Petrescu, A.S.21
Robertson, A.G.22
Schein, J.E.23
Siddiqui, A.24
Smailus, D.E.25
Stott, J.M.26
Yang, G.S.27
Plummer, F.28
Andonov, A.29
Artsob, H.30
Bastien, N.31
Bernard, K.32
Booth, T.F.33
Bowness, D.34
Czub, M.35
Drebot, M.36
Fernando, L.37
Flick, R.38
Garbutt, M.39
Gray, M.40
Grolla, A.41
Jones, S.42
Feldmann, H.43
Meyers, A.44
Kabani, A.45
Li, Y.46
Normand, S.47
Stroher, U.48
Tipples, G.A.49
Tyler, S.50
Vogrig, R.51
Ward, D.52
Watson, B.53
Brunham, R.C.54
Krajden, M.55
Petric, M.56
Skowronski, D.M.57
Upton, C.58
Roper, R.L.59
more..
-
7
-
-
0042164218
-
Unique and conserved features of genome and proteome of SARS-coronavirus, an early split-off from the coronavirus group 2 lineage
-
Snijder, E. J.; Bredenbeek, P. J.; Dobbe, J. C.; Thiel, V.; Ziebuhr, J.; Poon, L. L.; Guan, Y.; Rozanov, M.; Spaan, W. J.; Gorbalenya, A. E. Unique and conserved features of genome and proteome of SARS-coronavirus, an early split-off from the coronavirus group 2 lineage. J. Mol. Biol. 2003, 331, 991-1004.
-
(2003)
J. Mol. Biol.
, vol.331
, pp. 991-1004
-
-
Snijder, E.J.1
Bredenbeek, P.J.2
Dobbe, J.C.3
Thiel, V.4
Ziebuhr, J.5
Poon, L.L.6
Guan, Y.7
Rozanov, M.8
Spaan, W.J.9
Gorbalenya, A.E.10
-
8
-
-
0042377358
-
Mechanisms and enzymes involved in SARS coronavirus genome expression
-
Thiel, V.; Ivanov, K. A.; Putics, A.; Hertzig, T.; Schelle, B.; Bayer, S.; Weissbrich, B.; Snijder, E. J.; Rabenau, H.; Doerr, H. W.; Gorbalenya, A. E.; Ziebuhr, J. Mechanisms and enzymes involved in SARS coronavirus genome expression. J. Gen. Virol. 2003, 84, 2305-2315.
-
(2003)
J. Gen. Virol.
, vol.84
, pp. 2305-2315
-
-
Thiel, V.1
Ivanov, K.A.2
Putics, A.3
Hertzig, T.4
Schelle, B.5
Bayer, S.6
Weissbrich, B.7
Snijder, E.J.8
Rabenau, H.9
Doerr, H.W.10
Gorbalenya, A.E.11
Ziebuhr, J.12
-
9
-
-
0038120984
-
Coronavirus main proteinase (3CLpro) structure: Basis for design of anti-SARS drugs
-
Anand, K.; Ziebuhr, J.; Wadhwani, P.; Mesters, J. R.; Hilgenfeld, R. Coronavirus main proteinase (3CLpro) structure: basis for design of anti-SARS drugs. Science 2003, 300, 1763-1767.
-
(2003)
Science
, vol.300
, pp. 1763-1767
-
-
Anand, K.1
Ziebuhr, J.2
Wadhwani, P.3
Mesters, J.R.4
Hilgenfeld, R.5
-
10
-
-
0043237494
-
Modeling of the SARS coronavirus main proteinase and conformational flexibility of the active site
-
Liu, S.; Pei, J.; Chen, H.; Zhu, X.; Liu, Z.; Ma, W.; He, F.; Lai, L. Modeling of the SARS coronavirus main proteinase and conformational flexibility of the active site. Beijing Daxue Xuebao 2003, 35, 62-65.
-
(2003)
Beijing Daxue Xuebao
, vol.35
, pp. 62-65
-
-
Liu, S.1
Pei, J.2
Chen, H.3
Zhu, X.4
Liu, Z.5
Ma, W.6
He, F.7
Lai, L.8
-
11
-
-
12444278968
-
A 3D model of SARS_CoV 3CL proteinase and its inhibitors design by virtual screening
-
Xiong, B.; Gui, C. S.; Xu, X. Y.; Luo, C.; Chen, J.; Luo, H. B.; Chen, L. L.; Li, G. W.; Sun, T.; Yu, C. Y.; Yue, L. D.; Duan, W. H.; Shen, J. K.; Qin, L.; Shi, T. L.; Li, Y. X.; Chen, K. X.; Luo, X. M.; Shen, X.; Shen, J. H.; Jiang, H. L. A 3D model of SARS_CoV 3CL proteinase and its inhibitors design by virtual screening. Acta Pharm. Sin. 2003, 24, 497-504.
-
(2003)
Acta Pharm. Sin.
, vol.24
, pp. 497-504
-
-
Xiong, B.1
Gui, C.S.2
Xu, X.Y.3
Luo, C.4
Chen, J.5
Luo, H.B.6
Chen, L.L.7
Li, G.W.8
Sun, T.9
Yu, C.Y.10
Yue, L.D.11
Duan, W.H.12
Shen, J.K.13
Qin, L.14
Shi, T.L.15
Li, Y.X.16
Chen, K.X.17
Luo, X.M.18
Shen, X.19
Shen, J.H.20
Jiang, H.L.21
more..
-
12
-
-
21044456863
-
Cinanserin is an inhibitor of the 3C-like proteinase of severe acute respiratory syndrome coronavirus and strongly reduces virus replication in vitro
-
Chen, L.; Gui, C.; Luo, X.; Yang, Q.; Gunther, S.; Scandella, E.; Drosten, C.; Bai, D.; He, X.; Ludewig, B.; Chen, J.; Luo, H.; Yang, Y.; Yang, Y.; Zou, J.; Thiel, V.; Chen, K.; Shen, J.; Shen, X.; Jiang, H. Cinanserin is an inhibitor of the 3C-like proteinase of severe acute respiratory syndrome coronavirus and strongly reduces virus replication in vitro. J. Virol. 2005, 79, 7095-7103.
-
(2005)
J. Virol.
, vol.79
, pp. 7095-7103
-
-
Chen, L.1
Gui, C.2
Luo, X.3
Yang, Q.4
Gunther, S.5
Scandella, E.6
Drosten, C.7
Bai, D.8
He, X.9
Ludewig, B.10
Chen, J.11
Luo, H.12
Yang, Y.13
Yang, Y.14
Zou, J.15
Thiel, V.16
Chen, K.17
Shen, J.18
Shen, X.19
Jiang, H.20
more..
-
13
-
-
12844272193
-
Severe acute respiratory syndrome coronavirus 3C-like proteinase N terminus is indispensable for proteolytic activity but not for enzyme dimerization. Biochemical and thermodynamic investigation in conjunction with molecular dynamics simulations
-
Chen, S.; Chen, L.; Tan, J.; Chen, J.; Du, L.; Sun, T.; Shen, J.; Chen, K.; Jiang, H.; Shen, X. Severe acute respiratory syndrome coronavirus 3C-like proteinase N terminus is indispensable for proteolytic activity but not for enzyme dimerization. Biochemical and thermodynamic investigation in conjunction with molecular dynamics simulations. J. Biol. Chem. 2005, 280, 164-173.
-
(2005)
J. Biol. Chem.
, vol.280
, pp. 164-173
-
-
Chen, S.1
Chen, L.2
Tan, J.3
Chen, J.4
Du, L.5
Sun, T.6
Shen, J.7
Chen, K.8
Jiang, H.9
Shen, X.10
-
14
-
-
0242348704
-
Identifying inhibitors of the SARS coronavirus proteinase
-
Jenwitheesuk, E.; Samudrala, R. Identifying inhibitors of the SARS coronavirus proteinase. Bioorg. Med. Chem. Lett. 2003, 13, 3989-3992.
-
(2003)
Bioorg. Med. Chem. Lett.
, vol.13
, pp. 3989-3992
-
-
Jenwitheesuk, E.1
Samudrala, R.2
-
15
-
-
16244397353
-
SARS-CoV protease inhibitors design using virtual screening method from natural products libraries
-
Liu, B.; Zhou, J. SARS-CoV protease inhibitors design using virtual screening method from natural products libraries. J. Comput. Chem. 2005, 26, 484-490.
-
(2005)
J. Comput. Chem.
, vol.26
, pp. 484-490
-
-
Liu, B.1
Zhou, J.2
-
16
-
-
13844316622
-
Virtual screening of novel noncovalent inhibitors for SARS-CoV 3C-like proteinase
-
Liu, Z.; Huang, C.; Fan, K.; Wei, P.; Chen, H.; Liu, S.; Pei, J.; Shi, L.; Li, B.; Yang, K.; Liu, Y.; Lai, L. Virtual screening of novel noncovalent inhibitors for SARS-CoV 3C-like proteinase. J. Chem. Inf. Model. 2005, 45, 10-17.
-
(2005)
J. Chem. Inf. Model.
, vol.45
, pp. 10-17
-
-
Liu, Z.1
Huang, C.2
Fan, K.3
Wei, P.4
Chen, H.5
Liu, S.6
Pei, J.7
Shi, L.8
Li, B.9
Yang, K.10
Liu, Y.11
Lai, L.12
-
17
-
-
1242318794
-
Sabadinine: A potential non-peptide anti-severe acute-respiratory- syndrome agent identified using structure-aided design
-
Toney, J. H.; Navas-Martin, S.; Weiss, S. R.; Koeller, A. Sabadinine: a potential non-peptide anti-severe acute-respiratory-syndrome agent identified using structure-aided design. J. Med. Chem. 2004, 47, 1079-1080.
-
(2004)
J. Med. Chem.
, vol.47
, pp. 1079-1080
-
-
Toney, J.H.1
Navas-Martin, S.2
Weiss, S.R.3
Koeller, A.4
-
18
-
-
0041848237
-
Binding mechanism of coronavirus main proteinase with ligands and its implication to drug design against SARS
-
Chou, K. C.; Wei, D. Q.; Zhong, W. Z. Binding mechanism of coronavirus main proteinase with ligands and its implication to drug design against SARS. Biochem. Biophys. Res. Commun. 2003, 308, 148-151.
-
(2003)
Biochem. Biophys. Res. Commun.
, vol.308
, pp. 148-151
-
-
Chou, K.C.1
Wei, D.Q.2
Zhong, W.Z.3
-
19
-
-
2942750460
-
Virtual screening for SARS-CoV protease based on KZ7088 pharmacophore points
-
Sirois, S.; Wei, D. Q.; Du, Q.; Chou, K. C. Virtual screening for SARS-CoV protease based on KZ7088 pharmacophore points. J. Chem. Inf. Comput. Sci. 2004, 44, 1111-1122.
-
(2004)
J. Chem. Inf. Comput. Sci.
, vol.44
, pp. 1111-1122
-
-
Sirois, S.1
Wei, D.Q.2
Du, Q.3
Chou, K.C.4
-
20
-
-
11844290106
-
Generation of predictive pharmacophore model for SARS-coronavirus main proteinase
-
Zhang, X. W.; Yap, Y. L.; Altmeyer, R. M. Generation of predictive pharmacophore model for SARS-coronavirus main proteinase. Eur. J. Med. Chem. 2005, 40, 57-62.
-
(2005)
Eur. J. Med. Chem.
, vol.40
, pp. 57-62
-
-
Zhang, X.W.1
Yap, Y.L.2
Altmeyer, R.M.3
-
21
-
-
0036646055
-
Structure of coronavirus main proteinase reveals combination of a chymotrypsin fold with an extra alpha-helical domain
-
Anand, K.; Palm, G. J.; Mesters, J. R.; Siddell, S. G.; Ziebuhr, J.; Hilgenfeld, R. Structure of coronavirus main proteinase reveals combination of a chymotrypsin fold with an extra alpha-helical domain. EMBO J. 2002, 21, 3213-3224.
-
(2002)
EMBO J.
, vol.21
, pp. 3213-3224
-
-
Anand, K.1
Palm, G.J.2
Mesters, J.R.3
Siddell, S.G.4
Ziebuhr, J.5
Hilgenfeld, R.6
-
22
-
-
0345255626
-
The crystal structures of severe acute respiratory syndrome virus main protease and its complex with an inhibitor
-
Yang, H.; Yang, M.; Ding, Y.; Liu, Y.; Lou, Z.; Zhou, Z.; Sun, L.; Mo, L.; Ye, S.; Pang, H.; Gao, G. F.; Anand, K.; Bartlam, M.; Hilgenfeld, R.; Rao, Z. The crystal structures of severe acute respiratory syndrome virus main protease and its complex with an inhibitor. Proc. Natl. Acad. Sci. U.S.A. 2003, 100, 13190-13195.
-
(2003)
Proc. Natl. Acad. Sci. U.S.A.
, vol.100
, pp. 13190-13195
-
-
Yang, H.1
Yang, M.2
Ding, Y.3
Liu, Y.4
Lou, Z.5
Zhou, Z.6
Sun, L.7
Mo, L.8
Ye, S.9
Pang, H.10
Gao, G.F.11
Anand, K.12
Bartlam, M.13
Hilgenfeld, R.14
Rao, Z.15
-
24
-
-
19944378080
-
Synthesis and evaluation of isatin derivatives as effective SARS coronavirus 3CL protease inhibitors
-
Chen, L. R.; Wang, Y. C.; Lin, Y. W.; Chou, S. Y.; Chen, S. F.; Liu, L. T.; Wu, Y. T.; Kuo, C. J.; Chen, T. S.; Juang, S. H. Synthesis and evaluation of isatin derivatives as effective SARS coronavirus 3CL protease inhibitors. Bioorg. Med. Chem. Lett. 2005, 15, 3058-3062.
-
(2005)
Bioorg. Med. Chem. Lett.
, vol.15
, pp. 3058-3062
-
-
Chen, L.R.1
Wang, Y.C.2
Lin, Y.W.3
Chou, S.Y.4
Chen, S.F.5
Liu, L.T.6
Wu, Y.T.7
Kuo, C.J.8
Chen, T.S.9
Juang, S.H.10
-
25
-
-
24344464802
-
Inhibition of SARS-CoV 3C-like protease activity by theaflavin-3, 3′-digallate (TF3)
-
Chen, C. N.; Lin, C. P.; Huang, K. K.; Chen, W. C.; Hsieh, H. P.; Liang, P. H.; Hsu, J. T. Inhibition of SARS-CoV 3C-like protease activity by theaflavin-3,3′-digallate (TF3). Evidence-Based Complement. Alternat. Med. 2005, 2, 209-215.
-
(2005)
Evidence-Based Complement. Alternat. Med.
, vol.2
, pp. 209-215
-
-
Chen, C.N.1
Lin, C.P.2
Huang, K.K.3
Chen, W.C.4
Hsieh, H.P.5
Liang, P.H.6
Hsu, J.T.7
-
26
-
-
27444440007
-
A new lead for nonpeptidic active-site-directed inhibitors of the severe acute respiratory syndrome coronavirus main protease discovered by a combination of screening and docking methods
-
Kaeppler, U.; Stiefl, N.; Schiller, M.; Vicik, R.; Breuning, A.; Schmitz, W.; Rupprecht, D.; Schmuck, C.; Baumann, K.; Ziebuhr, J.; Schirmeister, T. A new lead for nonpeptidic active-site-directed inhibitors of the severe acute respiratory syndrome coronavirus main protease discovered by a combination of screening and docking methods. J. Med. Chem. 2005, 48, 6832-6842.
-
(2005)
J. Med. Chem.
, vol.48
, pp. 6832-6842
-
-
Kaeppler, U.1
Stiefl, N.2
Schiller, M.3
Vicik, R.4
Breuning, A.5
Schmitz, W.6
Rupprecht, D.7
Schmuck, C.8
Baumann, K.9
Ziebuhr, J.10
Schirmeister, T.11
-
27
-
-
3142594446
-
Small molecules targeting severe acute respiratory syndrome human coronavirus
-
Wu, C. Y.; Jan, J. T.; Ma, S. H.; Kuo, C. J.; Juan, H. F.; Cheng, Y. S.; Hsu, H. H.; Huang, H. C.; Wu, D.; Brik, A.; Liang, F. S.; Liu, R. S.; Fang, J. M.; Chen, S. T.; Liang, P. H.; Wong, C. H. Small molecules targeting severe acute respiratory syndrome human coronavirus. Proc. Natl. Acad. Sci. U.S.A. 2004, 101, 10012-10017.
-
(2004)
Proc. Natl. Acad. Sci. U.S.A.
, vol.101
, pp. 10012-10017
-
-
Wu, C.Y.1
Jan, J.T.2
Ma, S.H.3
Kuo, C.J.4
Juan, H.F.5
Cheng, Y.S.6
Hsu, H.H.7
Huang, H.C.8
Wu, D.9
Brik, A.10
Liang, F.S.11
Liu, R.S.12
Fang, J.M.13
Chen, S.T.14
Liang, P.H.15
Wong, C.H.16
-
28
-
-
30344480804
-
From genome to drug lead: Identification of a small-molecule inhibitor of the SARS virus
-
Dooley, A. J.; Shindo, N.; Taggart, B.; Park, J. G.; Pang, Y. P. From genome to drug lead: identification of a small-molecule inhibitor of the SARS virus. Bioorg. Med. Chem. Lett. 2006, 16, 830-833.
-
(2006)
Bioorg. Med. Chem. Lett.
, vol.16
, pp. 830-833
-
-
Dooley, A.J.1
Shindo, N.2
Taggart, B.3
Park, J.G.4
Pang, Y.P.5
-
29
-
-
5544272766
-
High-throughput screening identifies inhibitors of the SARS coronavirus main proteinase
-
Blanchard, J. E.; Elowe, N. H.; Huitema, C.; Fortin, P. D.; Cechetto, J. D.; Eltis, L. D.; Brown, E. D. High-throughput screening identifies inhibitors of the SARS coronavirus main proteinase. Chem. Biol. 2004, 11, 1445-1453.
-
(2004)
Chem. Biol.
, vol.11
, pp. 1445-1453
-
-
Blanchard, J.E.1
Elowe, N.H.2
Huitema, C.3
Fortin, P.D.4
Cechetto, J.D.5
Eltis, L.D.6
Brown, E.D.7
-
30
-
-
4644343545
-
Identification of novel small-molecule inhibitors of severe acute respiratory syndrome-associated coronavirus by chemical genetics
-
Kao, R. Y.; Tsui, W. H.; Lee, T. S.; Tanner, J. A.; Watt, R. M.; Huang, J. D.; Hu, L.; Chen, G.; Chen, Z.; Zhang, L.; He, T.; Chan, K. H.; Tse, H.; To, A. P.; Ng, L. W.; Wong, B. C.; Tsoi, H. W.; Yang, D.; Ho, D. D.; Yuen, K. Y. Identification of novel small-molecule inhibitors of severe acute respiratory syndrome-associated coronavirus by chemical genetics. Chem. Biol. 2004, 11, 1293-1299.
-
(2004)
Chem. Biol.
, vol.11
, pp. 1293-1299
-
-
Kao, R.Y.1
Tsui, W.H.2
Lee, T.S.3
Tanner, J.A.4
Watt, R.M.5
Huang, J.D.6
Hu, L.7
Chen, G.8
Chen, Z.9
Zhang, L.10
He, T.11
Chan, K.H.12
Tse, H.13
To, A.P.14
Ng, L.W.15
Wong, B.C.16
Tsoi, H.W.17
Yang, D.18
Ho, D.D.19
Yuen, K.Y.20
more..
-
31
-
-
6244283606
-
Critical evaluation of search algorithms for automated molecular docking and database screening
-
(31 ) Ewing, T. J. A.; Kuntz, I. D. Critical evaluation of search algorithms for automated molecular docking and database screening. J. Comput. Chem. 1997, 18, 1175-1189.
-
(1997)
J. Comput. Chem.
, vol.18
, pp. 1175-1189
-
-
Ewing, T.J.A.1
Kuntz, I.D.2
-
32
-
-
0029011701
-
A second generation force field for the simulation of proteins, nucleic acids and organic molecules
-
Cornell, W. D.; Cieplak, P.; Bayly, C. I.; Gould, I. R.; Merz, K. M.; Ferguson, D. M.; Spellmeyer, D. C.; Fox, T.; Caldwell, J. W.; Kollman, P. A. A second generation force field for the simulation of proteins, nucleic acids and organic molecules. J. Am. Chem. Soc. 1995, 117, 5179-5197.
-
(1995)
J. Am. Chem. Soc.
, vol.117
, pp. 5179-5197
-
-
Cornell, W.D.1
Cieplak, P.2
Bayly, C.I.3
Gould, I.R.4
Merz, K.M.5
Ferguson, D.M.6
Spellmeyer, D.C.7
Fox, T.8
Caldwell, J.W.9
Kollman, P.A.10
-
33
-
-
49149147973
-
Iterative partial equalization of orbital electronegativity-a rapid access to atomic charges
-
Gasteiger, J.; Marsili, M. Iterative partial equalization of orbital electronegativity-a rapid access to atomic charges. Tetrahedron 1980, 36, 3219-3228.
-
(1980)
Tetrahedron
, vol.36
, pp. 3219-3228
-
-
Gasteiger, J.1
Marsili, M.2
-
34
-
-
0000939786
-
Pi-charge distributions from molecular topology and pi-orbital electronegativity
-
Marsili, M.; Gasteiger, J. Pi-charge distributions from molecular topology and pi-orbital electronegativity. Croat. Chem. Acta 1980, 53, 601-614.
-
(1980)
Croat. Chem. Acta
, vol.53
, pp. 601-614
-
-
Marsili, M.1
Gasteiger, J.2
-
35
-
-
33751578897
-
Brief review and table of semiempirical parameters used in the Hiickel molecular orbital method
-
Purcell, W. P.; Singer, J. A. Brief review and table of semiempirical parameters used in the Hiickel molecular orbital method. J. Chem. Eng. Data 1967, 12, 235-246.
-
(1967)
J. Chem. Eng. Data
, vol.12
, pp. 235-246
-
-
Purcell, W.P.1
Singer, J.A.2
-
36
-
-
0348091307
-
-
The Tripos Associates: St. Louis, MO
-
SYBYL 6.9.1; The Tripos Associates: St. Louis, MO.
-
SYBYL 6.9.1
-
-
-
37
-
-
2442435903
-
Characterization of SARS main protease and inhibitor assay using a fluorogenic substrate
-
Kuo, C. J.; Chi, Y. H.; Hsu, J. T.; Liang, P. H. Characterization of SARS main protease and inhibitor assay using a fluorogenic substrate. Biochem. Biophys. Res. Commun. 2004, 318, 862-867.
-
(2004)
Biochem. Biophys. Res. Commun.
, vol.318
, pp. 862-867
-
-
Kuo, C.J.1
Chi, Y.H.2
Hsu, J.T.3
Liang, P.H.4
-
38
-
-
0003675575
-
-
International University Line: La Jolla, CA
-
Sutter, J. G. N. O.; Hoddmann, R.; Li, H.; Waldman, M. Pharmacophore, perception, development and use in drug design; International University Line: La Jolla, CA 2000; pp 504-506.
-
(2000)
Pharmacophore, Perception, Development and Use in Drug Design
, pp. 504-506
-
-
Sutter, J.G.N.O.1
Hoddmann, R.2
Li, H.3
Waldman, M.4
-
39
-
-
84988115618
-
Validation of the general purpose tripos 5.2 force field
-
M. Clark, R. D. C., III.; Van Opdenbosch, N. Validation of the General Purpose Tripos 5.2 Force Field. J. Comput. Chem. 1989, 10, 982-1012.
-
(1989)
J. Comput. Chem.
, vol.10
, pp. 982-1012
-
-
Clark, M.1
C. III, D.C.2
Van Opdenbosch, N.3
-
40
-
-
0023751431
-
Comparative molecular field analysis (CoMFA). 1. Effect of shape on binding of steroids to carrier proteins
-
Richard, D. C., III; Patterson, D. E.; Bunce, J. D. Comparative molecular field analysis (CoMFA). 1. Effect of shape on binding of steroids to carrier proteins. J. Am. Chem. Soc. 1988, 110, 5959-5967.
-
(1988)
J. Am. Chem. Soc.
, vol.110
, pp. 5959-5967
-
-
Richard III, D.C.1
Patterson, D.E.2
Bunce, J.D.3
-
41
-
-
33745147344
-
-
Catalyst, v. s. p.; Accelrys, Inc.: San Diego, CA 2003. (This was previously known as Molecular Simulations, Inc.; http://www. accelrys.com.)
-
Catalyst, v. s. p.; Accelrys, Inc.: San Diego, CA 2003. (This was previously known as Molecular Simulations, Inc.; http://www. accelrys.com.)
-
-
-
-
42
-
-
84986512474
-
CHARMM: A program for macromolecular energy, minimization and dynamics calculations
-
Brooks, B. R. B. R. E.; Olafson, B. D.; States, D. J.; Swaninathan, S.; Karplus, M. CHARMM: A program for macromolecular energy, minimization and dynamics calculations. J. Comput. Chem. 1983, 4, 187-217.
-
(1983)
J. Comput. Chem.
, vol.4
, pp. 187-217
-
-
Brooks, B.R.B.R.E.1
Olafson, B.D.2
States, D.J.3
Swaninathan, S.4
Karplus, M.5
-
43
-
-
84986522856
-
Poling: Promoting conformational variation
-
Smellie, A. T. S. L.; Tobwin, P. Poling: Promoting conformational variation. J. Comput. Chem. 1995, 16, 171-187.
-
(1995)
J. Comput. Chem.
, vol.16
, pp. 171-187
-
-
Smellie, A.T.S.L.1
Tobwin, P.2
-
44
-
-
0001398008
-
How well does a restrained electrostatic potential (RESP) model perform in calculating conformational energies of organic and biological molecules?
-
Wang, J.; Cieplak, P.; Kollman, P. A. How well does a restrained electrostatic potential (RESP) model perform in calculating conformational energies of organic and biological molecules? J. Comput. Chem. 2000, 21, 1049-1074.
-
(2000)
J. Comput. Chem.
, vol.21
, pp. 1049-1074
-
-
Wang, J.1
Cieplak, P.2
Kollman, P.A.3
-
45
-
-
2942532422
-
Development and testing of a general amber force field
-
Wang, J.; Wolf, R. M.; Caldwell, J. W.; Kollman, P. A.; Case, D. A. Development and testing of a general amber force field. 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.W.3
Kollman, P.A.4
Case, D.A.5
-
46
-
-
3042524904
-
A well-behaved electrostatic potential based method using charge restraints for deriving atomic charges: The RESP model
-
Bayly, C. L. C. P.; Cornell, W. D.; Kollman, P. A. 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.L.C.P.1
Cornell, W.D.2
Kollman, P.A.3
-
47
-
-
21244466002
-
-
University of California: San Francisco, CA
-
Case, D. A. P. D. A.; Caldwell, J. W.; Cheatham, T. E., III.; Wang, J.; Ross, W. S.; Simmerling, C. L.; Darden, T. A.; Merz, K. M.; Stanton, R. V.; Cheng, A. L.; Vincent, J. J.; Crowley, M.; Tsui, V.; Gohlke, H.; Radmer, R. J.; Duan, Y.; Pitera, J.; Massova, I.; Seibel, G. L.; Singh, U. C.; Weiner, P. K.; Kollman, P. A AMBER, version 8; University of California: San Francisco, CA, 2004.
-
(2004)
A AMBER, Version 8
-
-
Case, D.A.P.D.A.1
Caldwell, J.W.2
Cheatham III, T.E.3
Wang, J.4
Ross, W.S.5
Simmerling, C.L.6
Darden, T.A.7
Merz, K.M.8
Stanton, R.V.9
Cheng, A.L.10
Vincent, J.J.11
Crowley, M.12
Tsui, V.13
Gohlke, H.14
Radmer, R.J.15
Duan, Y.16
Pitera, J.17
Massova, I.18
Seibel, G.L.19
Singh, U.C.20
Weiner, P.K.21
Kollman, P.22
more..
-
48
-
-
14244273182
-
Theory and applications of the generalized Born solvation model in macromolecular simulations
-
Tsui, V.; Case, D. A. Theory and applications of the generalized Born solvation model in macromolecular simulations. Biopolymers 2000, 56, 275-291.
-
(2000)
Biopolymers
, vol.56
, pp. 275-291
-
-
Tsui, V.1
Case, D.A.2
|