-
1
-
-
0003156040
-
2 Ion Channel Protein and Its Role in the Influenza Virus Life Cycle
-
In;, Ed.; Cold Spring Harbor Press: Cold Spring Harbor, NY,; pp - 321.
-
2 Ion Channel Protein and Its Role in the Influenza Virus Life Cycle. In Receptor-Mediated Virus Entry into Cells; Wimmer, E., Ed.; Cold Spring Harbor Press: Cold Spring Harbor, NY, 1994; pp 303 - 321.
-
(1994)
Receptor-Mediated Virus Entry into Cells
, pp. 303
-
-
Lamb, R.A.1
Holsinger, L.J.2
Pinto, L.H.3
Wimmer, E.4
-
2
-
-
0021893484
-
2 protein is an integral membrane protein expressed on the infected-cell surface
-
2 protein is an integral membrane protein expressed on the infected-cell surface Cell 1985, 40, 627-633 (Pubitemid 15076578)
-
(1985)
Cell
, vol.40
, Issue.3
, pp. 627-633
-
-
Lamb, R.A.1
Zebedee, S.L.2
Richardson, C.D.3
-
3
-
-
0033783032
-
Receptor binding and membrane fusion in virus entry: The influenza hemagglutinin
-
Skehel, J. J.; Wiley, D. C. Receptor binding and membrane fusion in virus entry: the influenza hemagglutinin Annu. Rev. Biochem. 2000, 69, 531-569
-
(2000)
Annu. Rev. Biochem.
, vol.69
, pp. 531-569
-
-
Skehel, J.J.1
Wiley, D.C.2
-
4
-
-
0025266931
-
Solubilization of matrix protein M1/M from virions occurs at different pH for orthomyxo-and paramyxoviruses
-
DOI 10.1016/0042-6822(90)90253-N
-
Zhirnov, O. P. Solubilization of matrix protein M1/M from virions occurs at different pH for orthomyxo- and paramyxoviruses Virology 1990, 176, 274-279 (Pubitemid 20149691)
-
(1990)
Virology
, vol.176
, Issue.1
, pp. 274-279
-
-
Zhirnov, O.P.1
-
5
-
-
0026787707
-
Maturation of influenza A virus hemagglutinin-estimates of the pH encountered during transport and its regulation by the M2 protein
-
Grambas, S.; Hay, A. J. Maturation of influenza A virus hemagglutinin-estimates of the pH encountered during transport and its regulation by the M2 protein Virology 1992, 190, 11-18
-
(1992)
Virology
, vol.190
, pp. 11-18
-
-
Grambas, S.1
Hay, A.J.2
-
6
-
-
33646494326
-
Histidines, heart of the hydrogen ion channel from influenza A virus: Toward an understanding of conductance and proton selectivity
-
Hu, J.; Fu, R.; Nishimura, K.; Zhang, L.; Zhou, H.-X.; Busath, D. D.; Vijayvergiya, V.; Cross, T. A. Histidines, heart of the hydrogen ion channel from influenza A virus: toward an understanding of conductance and proton selectivity Proc. Natl. Acad. Sci. U.S.A. 2006, 103, 6865-6870
-
(2006)
Proc. Natl. Acad. Sci. U.S.A.
, vol.103
, pp. 6865-6870
-
-
Hu, J.1
Fu, R.2
Nishimura, K.3
Zhang, L.4
Zhou, H.-X.5
Busath, D.D.6
Vijayvergiya, V.7
Cross, T.A.8
-
7
-
-
33646932780
-
The M2 proton channels of influenza A and B viruses
-
DOI 10.1074/jbc.R500020200
-
Pinto, L. H. The M2 proton channels of influenza A and B viruses J. Biol. Chem. 2006, 281, 8997-9000 (Pubitemid 43864610)
-
(2006)
Journal of Biological Chemistry
, vol.281
, Issue.14
, pp. 8997-9000
-
-
Pinto, L.H.1
Lamb, R.A.2
-
8
-
-
37249016414
-
Anti-influenza virus agents: Synthesis and mode of action
-
DOI 10.1002/med.20096
-
Lagoja, I. M.; De Clercq, E. Anti-influenza virus agents: synthesis and mode of action Med. Res. Rev. 2008, 28, 1-38 (Pubitemid 350274960)
-
(2008)
Medicinal Research Reviews
, vol.28
, Issue.1
, pp. 1-38
-
-
Lagoja, I.M.1
De Clercq, E.2
-
9
-
-
0029665753
-
2 ion channel activity by BL-1743, an inhibitor of influenza A virus
-
2 ion channel activity by BL-1743, an inhibitor of influenza A virus J. Virol. 1996, 70, 4246-4252 (Pubitemid 26191137)
-
(1996)
Journal of Virology
, vol.70
, Issue.7
, pp. 4246-4252
-
-
Tu, Q.1
Pinto, L.H.2
Luo, G.3
Shaughnessy, M.A.4
Mullaney, D.5
Kurtz, S.6
Krystal, M.7
Lamb, R.A.8
-
10
-
-
67650540781
-
Discovery of spiro-piperidine inhibitors and their modulation of the dynamics of the M2 proton channel from influenza A virus
-
Wang, J.; Cady, S. D.; Balannik, V.; Pinto, L. H.; DeGrado, W. F.; Hong, M. Discovery of spiro-piperidine inhibitors and their modulation of the dynamics of the M2 proton channel from influenza A virus J. Am. Chem. Soc. 2009, 131, 8066-8076
-
(2009)
J. Am. Chem. Soc.
, vol.131
, pp. 8066-8076
-
-
Wang, J.1
Cady, S.D.2
Balannik, V.3
Pinto, L.H.4
Degrado, W.F.5
Hong, M.6
-
11
-
-
33644536465
-
Adamantane resistance among influenza A viruses isolated early during the 2005-2006 influenza season in the United States
-
Bright, R. A.; Shay, D. K.; Shu, B.; Cox, N. J.; Klimov, A. I. Adamantane resistance among influenza A viruses isolated early during the 2005-2006 influenza season in the United States JAMA, J. Am. Med. Assoc. 2006, 295, 891-894
-
(2006)
JAMA, J. Am. Med. Assoc.
, vol.295
, pp. 891-894
-
-
Bright, R.A.1
Shay, D.K.2
Shu, B.3
Cox, N.J.4
Klimov, A.I.5
-
12
-
-
58149345493
-
Structure of amantadine-bound M2 transmembrane peptide of influenza A in lipid bilayers from magic-angle-spinning solid-state NMR: The role of Ser31 in amantadine binding
-
Cady, S. D.; Mishanina, T. V.; Hong, M. Structure of amantadine-bound M2 transmembrane peptide of influenza A in lipid bilayers from magic-angle-spinning solid-state NMR: the role of Ser31 in amantadine binding J. Mol. Biol. 2009, 385, 1127-1141
-
(2009)
J. Mol. Biol.
, vol.385
, pp. 1127-1141
-
-
Cady, S.D.1
Mishanina, T.V.2
Hong, M.3
-
13
-
-
68249121326
-
Structure and function of the influenza A M2 proton channel
-
Cady, S. D.; Luo, W.; Hu, F.; Hong, M. Structure and function of the influenza A M2 proton channel Biochemistry 2009, 48, 7356-7364
-
(2009)
Biochemistry
, vol.48
, pp. 7356-7364
-
-
Cady, S.D.1
Luo, W.2
Hu, F.3
Hong, M.4
-
14
-
-
34447271704
-
Surveillance of resistance to adamantanes among influenza A(H3N2) and A(H1N1) viruses isolated worldwide
-
DOI 10.1086/518936
-
Deyde, V. M.; Xu, X.; Bright, R. A.; Shaw, M.; Smith, C. B.; Zhang, Y.; Shu, Y.; Gubareva, L. V.; Cox, N. J.; Klimov, A. I. Surveillance of resistance to adamantanes among influenza A(H3N2) and A(H1N1) viruses isolated worldwide J. Infect. Dis. 2007, 196, 249-257 (Pubitemid 47047464)
-
(2007)
Journal of Infectious Diseases
, vol.196
, Issue.2
, pp. 249-257
-
-
Deyde, V.M.1
Xu, X.2
Bright, R.A.3
Shaw, M.4
Smith, C.B.5
Zhang, Y.6
Shu, Y.7
Gubareva, L.V.8
Cox, N.J.9
Klimov, A.I.10
-
15
-
-
76249125649
-
Structure of the amantadine binding site of influenza M2 proton channels in lipid bilayers
-
Cady, S. D.; Schmidt-Rohr, K.; Wang, J.; Soto, C. S.; Degrado, W. F.; Hong, M. Structure of the amantadine binding site of influenza M2 proton channels in lipid bilayers Nature 2010, 463, 689-692
-
(2010)
Nature
, vol.463
, pp. 689-692
-
-
Cady, S.D.1
Schmidt-Rohr, K.2
Wang, J.3
Soto, C.S.4
Degrado, W.F.5
Hong, M.6
-
16
-
-
36549041108
-
Proton transport behavior through the influenza A M2 channel: Insights from molecular simulation
-
DOI 10.1529/biophysj.107.105742
-
Chen, H.; Wu, Y.; Voth, G. A. Proton transport behavior through the influenza A M2 channel: insights from molecular simulation Biophys. J. 2007, 93, 3470-3479 (Pubitemid 350190810)
-
(2007)
Biophysical Journal
, vol.93
, Issue.10
, pp. 3470-3479
-
-
Chen, H.1
Wu, Y.2
Voth, G.A.3
-
17
-
-
0027963402
-
Neutron diffraction reveals the site of amantadine blockade in the influenza A M2 ion channel
-
DOI 10.1006/viro.1994.1345
-
Duff, K. C.; Gilchrist, P. J.; Saxena, A. M.; Bradshaw, J. P. Neutron diffraction reveals the site of amantadine blockade in the influenza A M2 ion channel Virology 1994, 202, 287-293 (Pubitemid 24242001)
-
(1994)
Virology
, vol.202
, Issue.1
, pp. 287-293
-
-
Duff, K.C.1
Gilchrist, P.J.2
Saxena, A.M.3
Bradshaw, J.P.4
-
18
-
-
49449093199
-
Functional studies indicate amantadine binds to the pore of the influenza A virus M2 proton-selective ion channel
-
Jing, X.; Ma, C.; Ohigashi, Y.; Oliveira, F. A.; Jardetzky, T. S.; Pinto, L. H.; Lamb, R. A. Functional studies indicate amantadine binds to the pore of the influenza A virus M2 proton-selective ion channel Proc. Natl. Acad. Sci. U.S.A. 2008, 105, 10967-10972
-
(2008)
Proc. Natl. Acad. Sci. U.S.A.
, vol.105
, pp. 10967-10972
-
-
Jing, X.1
Ma, C.2
Ohigashi, Y.3
Oliveira, F.A.4
Jardetzky, T.S.5
Pinto, L.H.6
Lamb, R.A.7
-
19
-
-
59049103481
-
Molecular dynamics calculations suggest a conduction mechanism for the M2 proton channel from influenza A virus
-
Khurana, E.; Dal Peraro, M.; DeVane, R.; Vemparala, S.; DeGrado, W. F.; Klein, M. L. Molecular dynamics calculations suggest a conduction mechanism for the M2 proton channel from influenza A virus Proc. Natl. Acad. Sci. U.S.A. 2009, 106, 1069-1074
-
(2009)
Proc. Natl. Acad. Sci. U.S.A.
, vol.106
, pp. 1069-1074
-
-
Khurana, E.1
Dal Peraro, M.2
Devane, R.3
Vemparala, S.4
Degrado, W.F.5
Klein, M.L.6
-
20
-
-
38749151911
-
Structural basis for the function and inhibition of an influenza virus proton channel
-
DOI 10.1038/nature06528, PII NATURE06528
-
Stouffer, A. L.; Acharya, R.; Salom, D.; Levine, A. S.; Di Costanzo, L.; Soto, C. S.; Tereshko, V.; Nanda, V.; Stayrook, S.; DeGrado, W. F. Structural basis for the function and inhibition of an influenza virus proton channel Nature 2008, 451, 596-599 (Pubitemid 351186271)
-
(2008)
Nature
, vol.451
, Issue.7178
, pp. 596-599
-
-
Stouffer, A.L.1
Acharya, R.2
Salom, D.3
Levine, A.S.4
Di Costanzo, L.5
Soto, C.S.6
Tereshko, V.7
Nanda, V.8
Stayrook, S.9
DeGrado, W.F.10
-
21
-
-
49149107480
-
A secondary gate as a mechanism for inhibition of the M2 proton channel by amantadine
-
Yi, M.; Cross, T. A.; Zhou, H. X. A secondary gate as a mechanism for inhibition of the M2 proton channel by amantadine J. Phys. Chem. 2008, 112, 7977-7979
-
(2008)
J. Phys. Chem.
, vol.112
, pp. 7977-7979
-
-
Yi, M.1
Cross, T.A.2
Zhou, H.X.3
-
22
-
-
38749106195
-
Structure and mechanism of the M2 proton channel of influenza A virus
-
DOI 10.1038/nature06531, PII NATURE06531
-
Schnell, J. R.; Chou, J. J. Structure and mechanism of the M2 proton channel of influenza A virus Nature 2008, 451, 591-595 (Pubitemid 351186272)
-
(2008)
Nature
, vol.451
, Issue.7178
, pp. 591-595
-
-
Schnell, J.R.1
Chou, J.J.2
-
23
-
-
71449123670
-
An amantadine-sensitive chimeric BM2 ion channel of influenza B virus has implications for the mechanism of drug inhibition
-
Ohigashi, Y.; Ma, C.; Jing, X.; Balannick, V.; Pinto, L. H.; Lamb, R. A. An amantadine-sensitive chimeric BM2 ion channel of influenza B virus has implications for the mechanism of drug inhibition Proc. Natl. Acad. Sci. U.S.A. 2009, 106, 18775-18779
-
(2009)
Proc. Natl. Acad. Sci. U.S.A.
, vol.106
, pp. 18775-18779
-
-
Ohigashi, Y.1
Ma, C.2
Jing, X.3
Balannick, V.4
Pinto, L.H.5
Lamb, R.A.6
-
24
-
-
72449187005
-
Design and pharmacological characterization of inhibitors of amantadine-resistant mutants of the M2 ion channel of influenza A virus
-
Balannik, V.; Wang, J.; Ohigashi, Y.; Jing, X.; Magavern, E.; Lamb, R. A.; DeGrado, W. F.; Pinto, L. H. Design and pharmacological characterization of inhibitors of amantadine-resistant mutants of the M2 ion channel of influenza A virus Biochemistry 2009, 48, 11872-11882
-
(2009)
Biochemistry
, vol.48
, pp. 11872-11882
-
-
Balannik, V.1
Wang, J.2
Ohigashi, Y.3
Jing, X.4
Magavern, E.5
Lamb, R.A.6
Degrado, W.F.7
Pinto, L.H.8
-
25
-
-
75149171465
-
Functional studies and modeling of pore-lining residue mutants of the influenza a virus M2 ion channel
-
Balannik, V.; Carnevale, V.; Fiorin, G.; Levine, B. G.; Lamb, R. A.; Klein, M. L.; DeGrado, W. F.; Pinto, L. H. Functional studies and modeling of pore-lining residue mutants of the influenza a virus M2 ion channel Biochemistry 2010, 49, 696-708
-
(2010)
Biochemistry
, vol.49
, pp. 696-708
-
-
Balannik, V.1
Carnevale, V.2
Fiorin, G.3
Levine, B.G.4
Lamb, R.A.5
Klein, M.L.6
Degrado, W.F.7
Pinto, L.H.8
-
26
-
-
77956383657
-
Coexistence of two adamantane binding sites in the influenza A M2 ion channel
-
Rosenberg, M. R.; Casarotto, M. G. Coexistence of two adamantane binding sites in the influenza A M2 ion channel Proc. Natl. Acad. Sci. U.S.A. 2010, 107, 13866-13871
-
(2010)
Proc. Natl. Acad. Sci. U.S.A.
, vol.107
, pp. 13866-13871
-
-
Rosenberg, M.R.1
Casarotto, M.G.2
-
27
-
-
25844438380
-
Incidence of adamantane resistance among influenza A (H3N2) viruses isolated worldwide from 1994 to 2005: A cause for concern
-
DOI 10.1016/S0140-6736(05)67338-2, PII S0140673605673382
-
Bright, R. A.; Medina, M. J.; Xu, X.; Pérez-Oronoz, G.; Wallis, T. R.; Davis, X. M.; Povinelli, L.; Cox, N. J.; Klimov, A. I. Incidence of adamantane resistance among influenza A (H3N2) viruses isolated worldwide from 1994 to 2005: a cause for concern Lancet 2005, 366, 1175-1181 (Pubitemid 41393595)
-
(2005)
Lancet
, vol.366
, Issue.9492
, pp. 1175-1181
-
-
Bright, R.A.1
Medina, M.-J.2
Xu, X.3
Perez-Oronoz, G.4
Wallis, T.R.5
Davis, X.M.6
Povinelli, L.7
Cox, N.J.8
Klimov, A.I.9
-
28
-
-
0037951723
-
Frequency of amantadine-resistant influenza A viruses during two seasons featuring cocirculation of H1N1 and H3N2
-
DOI 10.1128/JCM.41.5.2164-2165.2003
-
Saito, R.; Sakai, T.; Sato, I.; Sano, Y.; Oshitani, H.; Sato, M.; Suzuki, H. Frequency of amantadine-resistant influenza A viruses during two seasons featuring cocirculation of H1N1 and H3N2 J. Clin. Microbiol. 2003, 41, 2164-2165 (Pubitemid 36576555)
-
(2003)
Journal of Clinical Microbiology
, vol.41
, Issue.5
, pp. 2164-2165
-
-
Saito, R.1
Sakai, T.2
Sato, I.3
Sano, Y.4
Oshitani, H.5
Sato, M.6
Suzuki, H.7
-
29
-
-
77953248210
-
Early pandemic influenza (2009 H1N1) in Ho Chi Minh City, Vietnam: A clinical virological and epidemiological analysis
-
e1000277
-
Hien, T. T.; Boni, M. F.; Bryant, J. E.; Ngan, T. T.; Wolbers, M.; Nguyen, T. D.; Truong, N. T.; Dung, N. T.; Ha do, Q.; Hien, V. M.; Thanh, T. T.; Nhu le, N. T.; Uyen le, T. T.; Nhien, P. T.; Chinh, N. T.; Chau, N. V.; Farrar, J.; van Doorn, H. R. Early pandemic influenza (2009 H1N1) in Ho Chi Minh City, Vietnam: a clinical virological and epidemiological analysis PLoS Med. 2010, 7 e1000277
-
(2010)
PLoS Med.
, vol.7
-
-
Hien, T.T.1
Boni, M.F.2
Bryant, J.E.3
Ngan, T.T.4
Wolbers, M.5
Nguyen, T.D.6
Truong, N.T.7
Dung, N.T.8
Ha Do, Q.9
Hien, V.M.10
Thanh, T.T.11
Nhu Le, N.T.12
Uyen Le, T.T.13
Nhien, P.T.14
Chinh, N.T.15
Chau, N.V.16
Farrar, J.17
Van Doorn, H.R.18
-
30
-
-
77953150445
-
Pandemic influenza A (H1N1) 2009 and mortality in the United Kingdom: Risk factors for death, April 2009 to March 2010
-
Pebody, R.; McLean, E.; Zhao, H.; Cleary, P.; Bracebridge, S.; Foster, K.; Charlett, A.; Hardelid, P.; Waight, P.; Ellis, J.; Bermingham, A.; Zambon, M.; Evans, B.; Salmon, R.; McMenamin, J.; Smyth, B.; Catchpole, M.; Watson, J. Pandemic influenza A (H1N1) 2009 and mortality in the United Kingdom: risk factors for death, April 2009 to March 2010. Eurosurveillance 2010, 15 (20).
-
(2010)
Eurosurveillance
, vol.15
, Issue.20
-
-
Pebody, R.1
McLean, E.2
Zhao, H.3
Cleary, P.4
Bracebridge, S.5
Foster, K.6
Charlett, A.7
Hardelid, P.8
Waight, P.9
Ellis, J.10
Bermingham, A.11
Zambon, M.12
Evans, B.13
Salmon, R.14
McMenamin, J.15
Smyth, B.16
Catchpole, M.17
Watson, J.18
-
31
-
-
0014541294
-
Synthesis and antiviral properties of 1-adamantylguanidine. A modified method for preparing t -alkylguanidines
-
Geluk, H. W.; Schut, J.; Schlatmann, J. L. M. A. Synthesis and antiviral properties of 1-adamantylguanidine. A modified method for preparing t -alkylguanidines J. Med. Chem. 1969, 12, 712-715
-
(1969)
J. Med. Chem.
, vol.12
, pp. 712-715
-
-
Geluk, H.W.1
Schut, J.2
Schlatmann, J.L.M.A.3
-
32
-
-
0015081224
-
Antiviral agents. 2. Structure-activity relationships of compounds related to 1-adamantanamine
-
Aldrich, P. E.; Hermann, E. C.; Meier, W. E.; Paulshock, M.; Prichard, W. W.; Snyder, J. A.; Watts, J. C. Antiviral agents. 2. Structure-activity relationships of compounds related to 1-adamantanamine J. Med. Chem. 1971, 14, 535-543
-
(1971)
J. Med. Chem.
, vol.14
, pp. 535-543
-
-
Aldrich, P.E.1
Hermann, E.C.2
Meier, W.E.3
Paulshock, M.4
Prichard, W.W.5
Snyder, J.A.6
Watts, J.C.7
-
33
-
-
0015290019
-
Synthesis and antiviral activities of adamantane spiro compounds. 1. Adamantane and analogous spiro-3′-pyrrolidines
-
Lundahl, K.; Schut, J.; Schlatmann, J. L. M. A.; Paerels, G. B.; Peters, A. Synthesis and antiviral activities of adamantane spiro compounds. 1. Adamantane and analogous spiro-3′-pyrrolidines J. Med. Chem. 1972, 15, 129-132
-
(1972)
J. Med. Chem.
, vol.15
, pp. 129-132
-
-
Lundahl, K.1
Schut, J.2
Schlatmann, J.L.M.A.3
Paerels, G.B.4
Peters, A.5
-
34
-
-
0015289394
-
Synthesis and antiviral activities of adamantane spiro compounds. 2
-
Van Hes, R.; Smit, A.; Kralt, T.; Peters, A. Synthesis and antiviral activities of adamantane spiro compounds. 2 J. Med. Chem. 1972, 15, 132-136
-
(1972)
J. Med. Chem.
, vol.15
, pp. 132-136
-
-
Van Hes, R.1
Smit, A.2
Kralt, T.3
Peters, A.4
-
35
-
-
0015676865
-
In vitro antiviral activity and preliminary clinical trials of a new adamantane compound
-
Mathur, A.; Beare, A. S.; Reed, S. E. In vitro antiviral activity and preliminary clinical trials of a new adamantane compound Antimicrob. Agents Chemother. 1973, 4, 421-426
-
(1973)
Antimicrob. Agents Chemother.
, vol.4
, pp. 421-426
-
-
Mathur, A.1
Beare, A.S.2
Reed, S.E.3
-
36
-
-
0016797738
-
Biologically active polycycloalkanes. 1. Antiviral adamantane derivatives
-
Aigami, K.; Inamoto, Y.; Takaishi, N.; Hattori, K.; Takatsuki, A.; Tamura, G. Biologically active polycycloalkanes. 1. Antiviral adamantane derivatives J. Med. Chem. 1975, 18, 713-721
-
(1975)
J. Med. Chem.
, vol.18
, pp. 713-721
-
-
Aigami, K.1
Inamoto, Y.2
Takaishi, N.3
Hattori, K.4
Takatsuki, A.5
Tamura, G.6
-
37
-
-
0028129705
-
Synthesis and antiviral activity evaluation of some aminoadamantane derivatives
-
Kolocouris, N.; Foscolos, G. B.; Kolocouris, A.; Marakos, P.; Pouli, N.; Fytas, G.; Ikeda, S.; De Clercq, E. Synthesis and antiviral activity of some aminoadamantane derivatives J. Med. Chem. 1994, 37, 2896-2902 (Pubitemid 24297806)
-
(1994)
Journal of Medicinal Chemistry
, vol.37
, Issue.18
, pp. 2896-2902
-
-
Kolocouris, N.1
Foscolos, G.B.2
Kolocouris, A.3
Marakos, P.4
Pouli, N.5
Fytas, G.6
Ikeda, S.7
De Clercq, E.8
-
38
-
-
0028129705
-
Synthesis and antiviral activity evaluation of some aminoadamantane derivatives
-
Kolocouris, N.; Kolocouris, A.; Foscolos, G. B.; Fytas, G.; Neyts, J.; Padalko, E.; Balzarini, J.; Snoeck, R.; Andrei, G.; De Clercq, E. Synthesis and antiviral activity of some new aminoadamantane derivatives. 2 J. Med. Chem. 1994, 37, 2896-2902 (Pubitemid 24297806)
-
(1994)
Journal of Medicinal Chemistry
, vol.37
, Issue.18
, pp. 2896-2902
-
-
Kolocouris, N.1
Foscolos, G.B.2
Kolocouris, A.3
Marakos, P.4
Pouli, N.5
Fytas, G.6
Ikeda, S.7
De Clercq, E.8
-
39
-
-
0032005664
-
How to overcome resistance of influenza A viruses against adamantane derivatives
-
DOI 10.1016/S0166-3542(97)00061-2, PII S0166354297000612
-
Scholtissek, C.; Quack, G.; Klenk, H. D.; Webster, R. G. How to overcome resistance of influenza A viruses against adamantane derivatives Antiviral Res. 1998, 37, 83-95 (Pubitemid 28186299)
-
(1998)
Antiviral Research
, vol.37
, Issue.2
, pp. 83-95
-
-
Scholtissek, C.1
Quack, G.2
Klenk, H.D.3
Webster, R.G.4
-
40
-
-
0344851554
-
Heterocyclic rimantadine analogues with antiviral activity
-
DOI 10.1016/j.bmc.2003.09.024
-
Stamatiou, G.; Foscolos, G. B.; Futas, G.; Kolocouris, A.; Kolocouris, N.; Pannecouque, C.; Witvrouw, M.; Padalko, E.; Neyts, J.; De Clercq, E. Heterocyclic rimantadine analogues with antiviral activity Bioorg. Med. Chem. 2003, 11, 5485-5492 (Pubitemid 37464675)
-
(2003)
Bioorganic and Medicinal Chemistry
, vol.11
, Issue.24
, pp. 5485-5492
-
-
Stamatiou, G.1
Foscolos, G.B.2
Fytas, G.3
Kolocouris, A.4
Kolocouris, N.5
Pannecouque, C.6
Witvrouw, M.7
Padalko, E.8
Neyts, J.9
Clercq, E.D.10
-
41
-
-
0038025788
-
Spiro[pyrrolidine-2,2′-adamantanes]: Synthesis, anti-influenza virus activity and conformational properties
-
DOI 10.1016/S0960-894X(03)00231-2
-
Stylianakais, I.; Kolocouris, A.; Kolocouris, N.; Fytas, G.; Foscolos, G. B.; Padalko, E.; Neyts, J.; De Clercq, E. Spiro[pyrrolidine-2,2′- adamantanes]: synthesis, anti-influenza virus activity and conformational properties Bioorg. Med. Chem. Lett. 2003, 13, 1699-1703 (Pubitemid 36561145)
-
(2003)
Bioorganic and Medicinal Chemistry Letters
, vol.13
, Issue.10
, pp. 1699-1703
-
-
Stylianakis, I.1
Kolocouris, A.2
Kolocouris, N.3
Fytas, G.4
Foscolos, G.B.5
Padalko, E.6
Neyts, J.7
De Clercq, E.8
-
42
-
-
0042236798
-
Are the 2-isomers of the drug rimantadine active anti-influenza A agents?
-
Zoidis, G.; Kolocouris, N.; Foscolos, G. B.; Kolocouris, A.; Fytas, G.; Karayannis, P.; Padalko, E.; Neyts, J.; De Clercq, E. Are the 2-isomers of the drug rimantadine active anti-influenza A agents? Antiviral Chem. Chemother. 2003, 14, 153-164 (Pubitemid 37087255)
-
(2003)
Antiviral Chemistry and Chemotherapy
, vol.14
, Issue.3
, pp. 153-164
-
-
Zoidis, G.1
Kolocouris, N.2
Foscolos, G.B.3
Kolocouris, A.4
Fytas, G.5
Karayannis, P.6
Padalko, E.7
Neyts, J.8
De Clercq, E.9
-
43
-
-
33748554044
-
Synthesis, conformational characteristics and anti-influenza virus A activity of some 2-adamantylsubstituted azacycles
-
DOI 10.1016/j.bioorg.2006.05.004, PII S0045206806000411
-
Setaki, D.; Tataridis, D.; Stamatiou, G.; Kolocouris, A.; Foscolos, G. B.; Fytas, G.; Kolocouris, N.; Padalko, E.; Neyts, J.; De Clercq, E. Synthesis, conformational characteristics and anti-influenza virus A activity of some 2-adamantylsubstituted azacycles Bioorg. Chem. 2006, 34, 248-273 (Pubitemid 44374634)
-
(2006)
Bioorganic Chemistry
, vol.34
, Issue.5
, pp. 248-273
-
-
Setaki, D.1
Tataridis, D.2
Stamatiou, G.3
Kolocouris, A.4
Foscolos, G.B.5
Fytas, G.6
Kolocouris, N.7
Padalko, E.8
Neyts, J.9
Clercq, E.D.10
-
44
-
-
33645859924
-
Heterocyclic rimantadine analogues with antiviral activity
-
Zoidis, G.; Fytas, C.; Papanastasiou, I.; Foscolos, G. B.; Fytas, G.; Padalko, E.; De Clercq, E.; Naesens, L.; Neyts, J.; Kolocouris, N. Heterocyclic rimantadine analogues with antiviral activity Bioorg. Med. Chem. 2006, 14, 3341-3348
-
(2006)
Bioorg. Med. Chem.
, vol.14
, pp. 3341-3348
-
-
Zoidis, G.1
Fytas, C.2
Papanastasiou, I.3
Foscolos, G.B.4
Fytas, G.5
Padalko, E.6
De Clercq, E.7
Naesens, L.8
Neyts, J.9
Kolocouris, N.10
-
45
-
-
33846204006
-
Influence of an additional 2-amino substituent of the 1-aminoethyl pharmacophore group on the potency of rimantadine against influenza virus A
-
DOI 10.1016/j.bmcl.2006.10.092, PII S0960894X06012790
-
Tataridis, D.; Fytas, G.; Kolocouris, A.; Fytas, C.; Kolocouris, N.; Foscolos, G. B.; Padalko, E.; Neyts, J.; De Clercq, E. Influence of an additional 2-amino substituent of the 1-aminoethyl pharmacophore group on the potency of rimantadine against influenza virus A Bioorg. Med. Chem. Lett. 2007, 17, 692-696 (Pubitemid 46108566)
-
(2007)
Bioorganic and Medicinal Chemistry Letters
, vol.17
, Issue.3
, pp. 692-696
-
-
Tataridis, D.1
Fytas, G.2
Kolocouris, A.3
Fytas, C.4
Kolocouris, N.5
Foscolos, G.B.6
Padalko, E.7
Neyts, J.8
De Clercq, E.9
-
46
-
-
34347400782
-
Design and synthesis of bioactive adamantane spiro heterocycles
-
DOI 10.1016/j.bmcl.2007.04.108, PII S0960894X07005537
-
Kolocouris, N.; Zoidis, G.; Foscolos, G. B.; Fytas, G.; Prathalingham, S. R.; Kelly, J. M.; De Clercq, E. Design and synthesis of bioactive adamantane spiro heterocycles Bioorg. Med. Chem. Lett. 2007, 17, 4358-4362 (Pubitemid 47021378)
-
(2007)
Bioorganic and Medicinal Chemistry Letters
, vol.17
, Issue.15
, pp. 4358-4362
-
-
Kolocouris, N.1
Zoidis, G.2
Foscolos, G.B.3
Fytas, G.4
Prathalingham, S.R.5
Kelly, J.M.6
Naesens, L.7
De Clercq, E.8
-
47
-
-
49549099275
-
Design and synthesis of bioactive 1,2-annulated adamantane derivatives
-
Zoidis, G.; Tsotinis, A.; Kolocouris, N.; Kelly, J. M.; Prathalingham, S. R.; Naesens, L.; De Clercq, E. Design and synthesis of bioactive 1,2-annulated adamantane derivatives Org. Biomol. Chem. 2008, 6, 3177-3185
-
(2008)
Org. Biomol. Chem.
, vol.6
, pp. 3177-3185
-
-
Zoidis, G.1
Tsotinis, A.2
Kolocouris, N.3
Kelly, J.M.4
Prathalingham, S.R.5
Naesens, L.6
De Clercq, E.7
-
48
-
-
55549087865
-
Comparisons of the influenza virus A M2 channel binding affinities, anti-influenza virus potencies and NMDA antagonistic activities of 2-alkyl-2-aminoadamantanes and analogues
-
Kolocouris, A.; Spearpoint, P.; Martin, S. R.; Hay, A. J.; López-Querol, M.; Sureda, F. X.; Padalko, E.; Neyts, J.; De Clercq, E. Comparisons of the influenza virus A M2 channel binding affinities, anti-influenza virus potencies and NMDA antagonistic activities of 2-alkyl-2-aminoadamantanes and analogues Bioorg. Med. Chem. Lett. 2008, 18, 6156-6160
-
(2008)
Bioorg. Med. Chem. Lett.
, vol.18
, pp. 6156-6160
-
-
Kolocouris, A.1
Spearpoint, P.2
Martin, S.R.3
Hay, A.J.4
López-Querol, M.5
Sureda, F.X.6
Padalko, E.7
Neyts, J.8
De Clercq, E.9
-
49
-
-
60049091637
-
Design and synthesis of 1,2-annulated adamantane piperidines with anti-influenza virus activity
-
Zoidis, G.; Kolocouris, N.; Naesens, L.; De Clercq, E. Design and synthesis of 1,2-annulated adamantane piperidines with anti-influenza virus activity Bioorg. Med. Chem. 2009, 17, 1534-1541
-
(2009)
Bioorg. Med. Chem.
, vol.17
, pp. 1534-1541
-
-
Zoidis, G.1
Kolocouris, N.2
Naesens, L.3
De Clercq, E.4
-
50
-
-
76449097553
-
Synthesis and anti-viral activity of azolo-adamantanes against influenza A virus
-
Zarubaev, V. V.; Golod, E. L.; Anfimov, P. M.; Shtro, A. A.; Saraev, V. V.; Gavrilov, A. S.; Logvinov, A. V.; Kiselev, O. I. Synthesis and anti-viral activity of azolo-adamantanes against influenza A virus Bioorg. Med. Chem. 2010, 18, 839-848
-
(2010)
Bioorg. Med. Chem.
, vol.18
, pp. 839-848
-
-
Zarubaev, V.V.1
Golod, E.L.2
Anfimov, P.M.3
Shtro, A.A.4
Saraev, V.V.5
Gavrilov, A.S.6
Logvinov, A.V.7
Kiselev, O.I.8
-
51
-
-
0014753337
-
Antiviral agents. I. Bicyclo[2.2.2]octan- and -oct-2-enamines
-
Whitney, J. G.; Gregory, W. A.; Kauer, J. C.; Roland, J. R.; Snyder, J. A.; Benson, R. E.; Hermann, E. C. Antiviral agents. I. Bicyclo[2.2.2]octan- and -oct-2-enamines J. Med. Chem. 1970, 13, 254-260
-
(1970)
J. Med. Chem.
, vol.13
, pp. 254-260
-
-
Whitney, J.G.1
Gregory, W.A.2
Kauer, J.C.3
Roland, J.R.4
Snyder, J.A.5
Benson, R.E.6
Hermann, E.C.7
-
52
-
-
0016797738
-
Biologically active polycycloalkanes. 1. Antiviral adamantane derivatives
-
Aigami, K.; Inamoto, Y.; Takaishi, N.; Hattori, K.; Takatsuki, A.; Tamura, G. Biologically active polycycloalkanes. 1. Antiviral adamantane derivatives J. Med. Chem. 1975, 18, 713-721
-
(1975)
J. Med. Chem.
, vol.18
, pp. 713-721
-
-
Aigami, K.1
Inamoto, Y.2
Takaishi, N.3
Hattori, K.4
Takatsuki, A.5
Tamura, G.6
-
53
-
-
0018691617
-
2,5]undecyl derivatives
-
DOI 10.1021/jm00196a011
-
2,5]undecyl derivatives J. Med. Chem. 1979, 22, 1206-1214 (Pubitemid 10237424)
-
(1979)
Journal of Medicinal Chemistry
, vol.22
, Issue.10
, pp. 1206-1214
-
-
Inamoto, Y.1
Aigami, K.2
Takaishi, N.3
-
54
-
-
0022499478
-
Prevention and treatment of experimental influenza A virus infection in volunteers with a new antiviral ICI 130,685
-
Al-Nakib, W.; Higgins, P. G.; Willman, J.; Tyrrell, D. A. J.; Swallow, D. L.; Hurst, B. C.; Rushton, A. Prevention and treatment of experimental influenza A virus infection in volunteers with a new antiviral ICI 130685 J. Antimicrob. Chemother. 1986, 18, 119-129 (Pubitemid 16070377)
-
(1986)
Journal of Antimicrobial Chemotherapy
, vol.18
, Issue.1
, pp. 119-129
-
-
Al-Nakib, W.1
Higgins, P.G.2
Willman, J.3
-
55
-
-
0028818109
-
Synthesis of substituted 1-norbornylamines with antiviral activity
-
García, A.; Teso, E.; García, A.; de la Moya, S.; Rodríguez, M. E.; Martínez, P.; Subramanian, L. R.; García, A. Synthesis of substituted 1-norbornylamines with antiviral activity J. Med. Chem. 1995, 38, 4474-4477
-
(1995)
J. Med. Chem.
, vol.38
, pp. 4474-4477
-
-
García, A.1
Teso, E.2
García, A.3
De La Moya, S.4
Rodríguez, M.E.5
Martínez, P.6
Subramanian, L.R.7
García, A.8
-
56
-
-
77952089169
-
Identification of hits as matrix-2 protein inhibitors through the focused screening of a small primary amine library
-
Hu, W.; Zeng, S.; Li, C.; Jie, Y.; Li, Z.; Chen, L. Identification of hits as matrix-2 protein inhibitors through the focused screening of a small primary amine library J. Med. Chem. 2010, 53, 3831-3834
-
(2010)
J. Med. Chem.
, vol.53
, pp. 3831-3834
-
-
Hu, W.1
Zeng, S.2
Li, C.3
Jie, Y.4
Li, Z.5
Chen, L.6
-
57
-
-
55749115608
-
Synthesis and pharmacological evaluation of several ring-contracted amantadine analogs
-
Camps, P.; Duque, M. D.; Vázquez, S.; Naesens, L.; De Clercq, E.; Sureda, F. S.; López-Querol, M.; Camins, A.; Pallàs, M.; Prathalingam, S. R.; Kelly, J. M.; Romero, V.; Ivorra, D.; Cortés, D. Synthesis and pharmacological evaluation of several ring-contracted amantadine analogs Bioorg. Med. Chem. 2008, 16, 9925-9936
-
(2008)
Bioorg. Med. Chem.
, vol.16
, pp. 9925-9936
-
-
Camps, P.1
Duque, M.D.2
Vázquez, S.3
Naesens, L.4
De Clercq, E.5
Sureda, F.S.6
López-Querol, M.7
Camins, A.8
Pallàs, M.9
Prathalingam, S.R.10
Kelly, J.M.11
Romero, V.12
Ivorra, D.13
Cortés, D.14
-
58
-
-
64049100364
-
Synthesis and pharmacological evaluation of (2-oxaadamant-1-yl)amines
-
Duque, M. D.; Camps, P.; Profire, L.; Montaner, S.; Vázquez, S.; Sureda, F. S.; Mallol, J.; López-Querol, M.; Naesens, L.; De Clercq, E.; Prathalingam, S. R.; Kelly, J. M. Synthesis and pharmacological evaluation of (2-oxaadamant-1-yl)amines Bioorg. Med. Chem. 2009, 17, 3198-3206
-
(2009)
Bioorg. Med. Chem.
, vol.17
, pp. 3198-3206
-
-
Duque, M.D.1
Camps, P.2
Profire, L.3
Montaner, S.4
Vázquez, S.5
Sureda, F.S.6
Mallol, J.7
López-Querol, M.8
Naesens, L.9
De Clercq, E.10
Prathalingam, S.R.11
Kelly, J.M.12
-
59
-
-
0000639860
-
Dodecahedranes and allied spherical molecules
-
Paquette, L. A. Dodecahedranes and allied spherical molecules Chem. Rev. 1989, 89, 1051-1065
-
(1989)
Chem. Rev.
, vol.89
, pp. 1051-1065
-
-
Paquette, L.A.1
-
60
-
-
0000588443
-
Multiple cycloaddition reaction of 9,10-dihydrofulvalene. New approach to 3,4,7-methenocyclopenta[ a ]pentalene derivatives
-
McNeil, D.; Vogt, B. R.; Sudol, J. J.; Theodoropulos, S.; Hedaya, E. Multiple cycloaddition reaction of 9,10-dihydrofulvalene. New approach to 3,4,7-methenocyclopenta[ a ]pentalene derivatives J. Am. Chem. Soc. 1974, 96, 4673-4674
-
(1974)
J. Am. Chem. Soc.
, vol.96
, pp. 4673-4674
-
-
McNeil, D.1
Vogt, B.R.2
Sudol, J.J.3
Theodoropulos, S.4
Hedaya, E.5
-
61
-
-
18744364644
-
Domino Diels-Alder reaction: 3,3a,3b,4,6a,7a-hexahydro-3,4,7-metheno-7 H -cyclopenta[ a ]pentalene-7,8-dicarboxylic acid
-
Taylor, R. T.; Pelter, M. W.; Paquette, L. A. Domino Diels-Alder reaction: 3,3a,3b,4,6a,7a-hexahydro-3,4,7-metheno-7 H -cyclopenta[ a ]pentalene-7,8-dicarboxylic acid Org. Synth. 1990, 68, 198-205
-
(1990)
Org. Synth.
, vol.68
, pp. 198-205
-
-
Taylor, R.T.1
Pelter, M.W.2
Paquette, L.A.3
-
63
-
-
77956364593
-
Computational study of drug binding to the membrane-bound tetrameric M2 peptide bundle from influenza A virus
-
Khurana, E.; DeVane, R. H.; Dal Peraro, M.; Klein, M. L. Computational study of drug binding to the membrane-bound tetrameric M2 peptide bundle from influenza A virus Biochim. Biophys. Acta 2011, 1808, 530-537
-
(2011)
Biochim. Biophys. Acta
, vol.1808
, pp. 530-537
-
-
Khurana, E.1
Devane, R.H.2
Dal Peraro, M.3
Klein, M.L.4
-
64
-
-
77956996035
-
Structure and mechanism of proton transport through the transmembrane tetrameric M2 protein bundle of the influenza A virus
-
Acharya, R.; Carnevale, V.; Fiorin, G.; Levine, B. G.; Polischuk, A. L.; Balannik, V.; Samish, I.; Lamb, R. A.; Pinto, L. H.; DeGrado, W. F.; Klein, M. L. Structure and mechanism of proton transport through the transmembrane tetrameric M2 protein bundle of the influenza A virus Proc. Natl. Acad. Sci. U.S.A. 2010, 107, 15075-15080
-
(2010)
Proc. Natl. Acad. Sci. U.S.A.
, vol.107
, pp. 15075-15080
-
-
Acharya, R.1
Carnevale, V.2
Fiorin, G.3
Levine, B.G.4
Polischuk, A.L.5
Balannik, V.6
Samish, I.7
Lamb, R.A.8
Pinto, L.H.9
Degrado, W.F.10
Klein, M.L.11
-
65
-
-
47049086607
-
Identification of the pore-lining residues of the BM2 ion channel protein of influenza B virus
-
Ma, C.; Soto, C. S.; Ohigashi, Y.; Taylor, A.; Bournas, V.; Glawe, B.; Udo, M. K.; DeGrado, W. F.; Lamb, R. A.; Pinto, L. H. Identification of the pore-lining residues of the BM2 ion channel protein of influenza B virus J. Biol. Chem. 2008, 283, 15921-15931
-
(2008)
J. Biol. Chem.
, vol.283
, pp. 15921-15931
-
-
Ma, C.1
Soto, C.S.2
Ohigashi, Y.3
Taylor, A.4
Bournas, V.5
Glawe, B.6
Udo, M.K.7
Degrado, W.F.8
Lamb, R.A.9
Pinto, L.H.10
-
66
-
-
77950840696
-
Novel inhibitors of influenza virus fusion: Structure-activity relationship and interaction with the viral hemagglutinin
-
Vanderlinden, E.; Göktas, F.; Cesur, Z.; Froeyen, M.; Reed, M. L.; Russell, C. J.; Cesur, N.; Naesens, L. Novel inhibitors of influenza virus fusion: structure-activity relationship and interaction with the viral hemagglutinin J. Virol. 2010, 84, 4277-4288
-
(2010)
J. Virol.
, vol.84
, pp. 4277-4288
-
-
Vanderlinden, E.1
Göktas, F.2
Cesur, Z.3
Froeyen, M.4
Reed, M.L.5
Russell, C.J.6
Cesur, N.7
Naesens, L.8
-
67
-
-
30344440627
-
-
version 9; University of California: San Francisco, CA.
-
Case, D. A.; Darden, T. A.; Cheatham, T. E., III; Simmerling, C. L.; Wang, J.; Duke, R. E.; Luo, R.; Merz, K. M.; Pearlman, D. A.; Crowley, M.; Walker, R. C.; Zhang, W.; Wang, B.; Hayik, S; Roitberg, A.; Seabra, G.; Wong, K. F.; Paesani, F.; Wu, X.; Brozell, S.; Tsui, V.; Gohlke, H.; Yang, L.; Tan, C.; Mongan, J.; Hornak, V.; Cui, G.; Beroza, P.; Mathews, D. H.; Schafmeister, C.; Ross, W. S.; Kollman, P. A. AMBER, version 9; University of California: San Francisco, CA, 2006.
-
(2006)
AMBER
-
-
Case, D.A.1
Darden, T.A.2
Cheatham III, T.E.3
Simmerling, C.L.4
Wang, J.5
Duke, R.E.6
Luo, R.7
Merz, K.M.8
Pearlman, D.A.9
Crowley, M.10
Walker, R.C.11
Zhang, W.12
Wang, B.13
Hayik, S.14
Roitberg, A.15
Seabra, G.16
Wong, K.F.17
Paesani, F.18
Wu, X.19
Brozell, S.20
Tsui, V.21
Gohlke, H.22
Yang, L.23
Tan, C.24
Mongan, J.25
Hornak, V.26
Cui, G.27
Beroza, P.28
Mathews, D.H.29
Schafmeister, C.30
Ross, W.S.31
Kollman, P.A.32
more..
-
68
-
-
33748518255
-
Comparison of multiple amber force fields and development of improved protein backbone parameters
-
DOI 10.1002/prot.21123
-
Hornak, V.; Abel, R.; Okur, A.; Strockbine, B.; Roitberg, A.; Simmerling, C. Comparison of multiple Amber force fields and development of improved protein backbone parameters Proteins: Struct., Funct., Bioinf. 2006, 65, 712-725 (Pubitemid 44583220)
-
(2006)
Proteins: Structure, Function and Genetics
, vol.65
, Issue.3
, pp. 712-725
-
-
Hornak, V.1
Abel, R.2
Okur, A.3
Strockbine, B.4
Roitberg, A.5
Simmerling, C.6
-
69
-
-
5544242529
-
MMFF VI. MMFF94s option for energy minimization studies
-
Halgren, T. A.; MMFF, V. I. MMFF94s option for energy minimization studies J. Comput. Chem. 1999, 20, 720-729 (Pubitemid 129652635)
-
(1999)
Journal of Computational Chemistry
, vol.20
, Issue.7
, pp. 720-729
-
-
Halgren, T.A.1
-
70
-
-
4043058000
-
Validation of an empirical RNA-ligand scoring function for fast flexible docking using RiboDock®
-
DOI 10.1023/B:JCAM.0000035199.48747.1e
-
Morley, S. D.; Afshar, M. Validation of an empirical RNA-ligand scoring function for fast flexible docking using RiboDock J.Comput.-Aided Mol. Des. 2004, 18, 189-208 (Pubitemid 39069414)
-
(2004)
Journal of Computer-Aided Molecular Design
, vol.18
, Issue.3
, pp. 189-208
-
-
Morley, S.D.1
Afshar, M.2
-
71
-
-
4344632851
-
Virtual screening in structure-based drug discovery
-
Barril, X.; Hubbard, R. E.; Morley, S. D. Virtual screening in structure-based drug discovery Mini-Rev. Med. Chem. 2004, 4, 779-791 (Pubitemid 39149478)
-
(2004)
Mini-Reviews in Medicinal Chemistry
, vol.4
, Issue.7
, pp. 779-791
-
-
Barril, X.1
Hubbard, R.E.2
Morley, S.D.3
-
72
-
-
0004016501
-
Comparison of simple potential functions for simulating liquid water
-
Jorgensen, W. L.; Chandrasekhar, J.; Madura, J. D.; Impey, R. W.; Klein, M. L. 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
Impey, R.W.4
Klein, M.L.5
-
73
-
-
3042524904
-
A well-behaved electrostatic potential based method using charge restraints for deriving atomic charges: The RESP model
-
Bayly, C. I.; Cieplak, P.; Cornell, W.; 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.I.1
Cieplak, P.2
Cornell, W.3
Kollman, P.A.4
-
74
-
-
33846863158
-
Solvated Interaction Energy (SIE) for scoring protein-ligand binding affinities. 1. Exploring the parameter space
-
DOI 10.1021/ci600406v
-
Naïm, M.; Bhat, S.; Rankin, K. N.; Dennis, S.; Chowdhury, S. F.; Siddiqi, I.; Drabik, P.; Sulea, T.; Bayly, C. I.; Jakalian, A.; Purisima, E. O. Solvated interaction energy (SIE) for scoring protein-ligand binding affinities. 1. Exploring the parameter space J. Chem. Inf. Model. 2007, 47, 122-133 (Pubitemid 46225568)
-
(2007)
Journal of Chemical Information and Modeling
, vol.47
, Issue.1
, pp. 122-133
-
-
Naim, M.1
Bhat, S.2
Rankin, K.N.3
Dennis, S.4
Chowdhury, S.F.5
Siddiqi, I.6
Drabik, P.7
Sulea, T.8
Bayly, C.I.9
Jakalian, A.10
Purisima, E.O.11
-
75
-
-
44149094011
-
Molecular dynamics-solvated interaction energy studies of protein-protein interactions: The MP1-p14 scaffolding complex
-
Cui, Q.; Sulea, T.; Schrag, J. D.; Munger, C.; Hung, M.-N.; Naïm, M.; Cygler, M.; Purisima, E. O. Molecular dynamics-solvated interaction energy studies of protein-protein interactions: the MP1-p14 scaffolding complex J. Mol. Biol. 2008, 379, 787-802
-
(2008)
J. Mol. Biol.
, vol.379
, pp. 787-802
-
-
Cui, Q.1
Sulea, T.2
Schrag, J.D.3
Munger, C.4
Hung, M.-N.5
Naïm, M.6
Cygler, M.7
Purisima, E.O.8
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