-
1
-
-
0031022918
-
Specialized membrane domains for water transport in glial cells: High-resolution immunogold cytochemistry of aquaporin-4 in rat brain
-
Nielsen, S.; Nagelhus, E. A.; Amiry-Moghaddam, M.; Bourque, C.; Agre, P.; Ottersen, O. P. Specialized membrane domains for water transport in glial cells: High-resolution immunogold cytochemistry of aquaporin-4 in rat brain. J. Neurosci. Off. J. Soc. Neurosci. 1997, 17, 171-180.
-
(1997)
J. Neurosci. Off. J. Soc. Neurosci
, vol.17
, pp. 171-180
-
-
Nielsen, S.1
Nagelhus, E.A.2
Amiry-Moghaddam, M.3
Bourque, C.4
Agre, P.5
Ottersen, O.P.6
-
2
-
-
0032853219
-
Cellular and molecular biology of the aquaporin water channels
-
[CrossRef] [PubMed]
-
Borgnia, M.; Nielsen, S.; Engel, A.; Agre, P. Cellular and molecular biology of the aquaporin water channels. Annu. Rev. Biochem. 1999, 68, 425-458. [CrossRef] [PubMed].
-
(1999)
Annu. Rev. Biochem
, vol.68
, pp. 425-458
-
-
Borgnia, M.1
Nielsen, S.2
Engel, A.3
Agre, P.4
-
3
-
-
0035924329
-
Structural basis of water-specific transport through the AQP1 water channel
-
[CrossRef] [PubMed]
-
Sui, H.; Han, B. G.; Lee, J. K.; Walian, P.; Jap, B. K. Structural basis of water-specific transport through the AQP1 water channel. Nature 2001, 414, 872-878. [CrossRef] [PubMed].
-
(2001)
Nature
, vol.414
, pp. 872-878
-
-
Sui, H.1
Han, B.G.2
Lee, J.K.3
Walian, P.4
Jap, B.K.5
-
4
-
-
84899127684
-
Insights into structural mechanisms of gating induced regulation of aquaporins
-
[CrossRef] [PubMed]
-
Sachdeva, R.; Singh, B. Insights into structural mechanisms of gating induced regulation of aquaporins. Prog. Biophys. Mol. Biol. 2014, 114, 69-79. [CrossRef] [PubMed].
-
(2014)
Prog. Biophys. Mol. Biol
, vol.114
, pp. 69-79
-
-
Sachdeva, R.1
Singh, B.2
-
5
-
-
1842583051
-
The mechanism of proton exclusion in aquaporin channels
-
[CrossRef] [PubMed]
-
Ilan, B.; Tajkhorshid, E.; Schulten, K.; Voth, G. A. The mechanism of proton exclusion in aquaporin channels. Proteins 2004, 55, 223-228. [CrossRef] [PubMed].
-
(2004)
Proteins
, vol.55
, pp. 223-228
-
-
Ilan, B.1
Tajkhorshid, E.2
Schulten, K.3
Voth, G.A.4
-
6
-
-
79952449205
-
Enhancement of proton conductance by mutations of the selectivity filter of aquaporin-1
-
[CrossRef] [PubMed]
-
Li, H.; Chen, H.; Steinbronn, C.; Wu, B.; Beitz, E.; Zeuthen, T.; Voth, G. A. Enhancement of proton conductance by mutations of the selectivity filter of aquaporin-1. J. Mol. Biol. 2011, 407, 607-620. [CrossRef] [PubMed].
-
(2011)
J. Mol. Biol
, vol.407
, pp. 607-620
-
-
Li, H.1
Chen, H.2
Steinbronn, C.3
Wu, B.4
Beitz, E.5
Zeuthen, T.6
Voth, G.A.7
-
7
-
-
39549085136
-
Mechanism of selectivity in aquaporins and aquaglyceroporins
-
[CrossRef] [PubMed]
-
Hub, J. S.; de Groot, B. L. Mechanism of selectivity in aquaporins and aquaglyceroporins. Proc. Natl. Acad. Sci. USA 2008, 105, 1198-1203. [CrossRef] [PubMed].
-
(2008)
Proc. Natl. Acad. Sci. USA
, vol.105
, pp. 1198-1203
-
-
Hub, J.S.1
de Groot, B.L.2
-
8
-
-
0026806764
-
Reconstitution of functional water channels in liposomes containing purified red cell CHIP28 protein
-
[CrossRef] [PubMed]
-
Zeidel, M. L.; Ambudkar, S. V.; Smith, B. L.; Agre, P. Reconstitution of functional water channels in liposomes containing purified red cell CHIP28 protein. Biochemistry 1992, 31, 7436-7440. [CrossRef] [PubMed].
-
(1992)
Biochemistry
, vol.31
, pp. 7436-7440
-
-
Zeidel, M.L.1
Ambudkar, S.V.2
Smith, B.L.3
Agre, P.4
-
9
-
-
0036661083
-
Aquaporin water channels-From atomic structure to clinical medicine
-
[CrossRef] [PubMed]
-
Agre, P.; King, L. S.; Yasui, M.; Guggino, W. B.; Ottersen, O. P.; Fujiyoshi, Y.; Engel, A.; Nielsen, S. Aquaporin water channels-From atomic structure to clinical medicine. J. Physiol. 2002, 542, 3-16. [CrossRef] [PubMed].
-
(2002)
J. Physiol
, vol.542
, pp. 3-16
-
-
Agre, P.1
King, L.S.2
Yasui, M.3
Guggino, W.B.4
Ottersen, O.P.5
Fujiyoshi, Y.6
Engel, A.7
Nielsen, S.8
-
10
-
-
84896971047
-
Human aquaporins: Regulators of transcellular water flow
-
[CrossRef] [PubMed]
-
Day, R. E.; Kitchen, P.; Owen, D. S.; Bland, C.; Marshall, L.; Conner, A. C.; Bill, R. M.; Conner, M. T. Human aquaporins: Regulators of transcellular water flow. Biochim. Biophys. Acta 2014, 1840, 1492-1506. [CrossRef] [PubMed].
-
(2014)
Biochim. Biophys. Acta
, vol.1840
, pp. 1492-1506
-
-
Day, R.E.1
Kitchen, P.2
Owen, D.S.3
Bland, C.4
Marshall, L.5
Conner, A.C.6
Bill, R.M.7
Conner, M.T.8
-
11
-
-
36849001485
-
Aquaporin-related disorders of water homeostasis
-
[CrossRef] [PubMed]
-
Schrier, R. W. Aquaporin-related disorders of water homeostasis. Drug News Perspect. 2007, 20, 447-453. [CrossRef] [PubMed].
-
(2007)
Drug News Perspect
, vol.20
, pp. 447-453
-
-
Schrier, R.W.1
-
12
-
-
0242573122
-
Aquaporin water channels: Molecular mechanisms for human diseases 1
-
[CrossRef]
-
Agre, P.; Kozono, D. Aquaporin water channels: Molecular mechanisms for human diseases 1. FEBS Lett. 2003, 555, 72-78. [CrossRef].
-
(2003)
FEBS Lett
, vol.555
, pp. 72-78
-
-
Agre, P.1
Kozono, D.2
-
13
-
-
23944444890
-
IgG marker of optic-spinal multiple sclerosis binds to the aquaporin-4 water channel
-
[CrossRef] [PubMed]
-
Lennon, V. A.; Kryzer, T. J.; Pittock, S. J.; Verkman, A. S.; Hinson, S. R. IgG marker of optic-spinal multiple sclerosis binds to the aquaporin-4 water channel. J. Exp. Med. 2005, 202, 473-477. [CrossRef] [PubMed].
-
(2005)
J. Exp. Med
, vol.202
, pp. 473-477
-
-
Lennon, V.A.1
Kryzer, T.J.2
Pittock, S.J.3
Verkman, A.S.4
Hinson, S.R.5
-
14
-
-
17044366269
-
Aquaporins as targets for drug discovery
-
[CrossRef]
-
Castle, N. A. Aquaporins as targets for drug discovery. Drug Discov. Today 2005, 10, 485-493. [CrossRef].
-
(2005)
Drug Discov. Today
, vol.10
, pp. 485-493
-
-
Castle, N.A.1
-
15
-
-
0141534474
-
The mechanism of proton exclusion in the aquaporin-1 water channel
-
[CrossRef] [PubMed]
-
De Groot, B. L.; Frigato, T.; Helms, V.; Grubmüller, H. The mechanism of proton exclusion in the aquaporin-1 water channel. J. Mol. Biol. 2003, 333, 279-293. [CrossRef] [PubMed].
-
(2003)
J. Mol. Biol
, vol.333
, pp. 279-293
-
-
De Groot, B.L.1
Frigato, T.2
Helms, V.3
Grubmüller, H.4
-
16
-
-
61449455404
-
Dynamics and energetics of permeation through aquaporins. What do we learn from molecular dynamics simulations?
-
Hub, J. S.; Grubmüller, H.; de Groot, B. L. Dynamics and energetics of permeation through aquaporins. What do we learn from molecular dynamics simulations? Handb. Exp. Pharmacol. 2009, 190, 57-76.
-
(2009)
Handb. Exp. Pharmacol
, vol.190
, pp. 57-76
-
-
Hub, J.S.1
Grubmüller, H.2
de Groot, B.L.3
-
17
-
-
78650183853
-
Voltage-regulated water flux through aquaporin channels in silico
-
[CrossRef] [PubMed]
-
Hub, J. S.; Aponte-Santamaría, C.; Grubmüller, H.; de Groot, B. L. Voltage-regulated water flux through aquaporin channels in silico. Biophys. J. 2010, 99, L97-L99. [CrossRef] [PubMed].
-
(2010)
Biophys. J
, vol.99
, pp. L97-L99
-
-
Hub, J.S.1
Aponte-Santamaría, C.2
Grubmüller, H.3
de Groot, B.L.4
-
18
-
-
84862514339
-
Molecular driving forces defining lipid positions around aquaporin-0
-
[CrossRef] [PubMed]
-
Aponte-Santamaría, C.; Briones, R.; Schenk, A. D.; Walz, T.; de Groot, B. L. Molecular driving forces defining lipid positions around aquaporin-0. Proc. Natl. Acad. Sci. USA 2012, 109, 9887-9892. [CrossRef] [PubMed].
-
(2012)
Proc. Natl. Acad. Sci. USA
, vol.109
, pp. 9887-9892
-
-
Aponte-Santamaría, C.1
Briones, R.2
Schenk, A.D.3
Walz, T.4
de Groot, B.L.5
-
19
-
-
84872550207
-
Discovery of novel human aquaporin-1 blockers
-
[CrossRef] [PubMed]
-
Seeliger, D.; Zapater, C.; Krenc, D.; Haddoub, R.; Flitsch, S.; Beitz, E.; Cerdà, J.; de Groot, B. L. Discovery of novel human aquaporin-1 blockers. ACS Chem. Biol. 2013, 8, 249-256. [CrossRef] [PubMed].
-
(2013)
ACS Chem. Biol
, vol.8
, pp. 249-256
-
-
Seeliger, D.1
Zapater, C.2
Krenc, D.3
Haddoub, R.4
Flitsch, S.5
Beitz, E.6
Cerdà, J.7
de Groot, B.L.8
-
20
-
-
84879607006
-
Phosphorylation of rat aquaporin-4 at Ser111 is not required for channel gating
-
[CrossRef] [PubMed]
-
Assentoft, M.; Kaptan, S.; Fenton, R. A.; Hua, S. Z.; de Groot, B. L.; MacAulay, N. Phosphorylation of rat aquaporin-4 at Ser111 is not required for channel gating. Glia 2013, 61, 1101-1112. [CrossRef] [PubMed].
-
(2013)
Glia
, vol.61
, pp. 1101-1112
-
-
Assentoft, M.1
Kaptan, S.2
Fenton, R.A.3
Hua, S.Z.4
de Groot, B.L.5
McAulay, N.6
-
21
-
-
66149097844
-
Crystal structure of human aquaporin 4 at 1. 8 A and its mechanism of conductance
-
[CrossRef] [PubMed]
-
Ho, J. D.; Yeh, R.; Sandstrom, A.; Chorny, I.; Harries, W. E. C.; Robbins, R. A.; Miercke, L. J. W.; Stroud, R. M. Crystal structure of human aquaporin 4 at 1. 8 A and its mechanism of conductance. Proc. Natl. Acad. Sci. USA 2009, 106, 7437-7442. [CrossRef] [PubMed].
-
(2009)
Proc. Natl. Acad. Sci. USA
, vol.106
, pp. 7437-7442
-
-
Ho, J.D.1
Yeh, R.2
Sandstrom, A.3
Chorny, I.4
Harries, W.E.C.5
Robbins, R.A.6
Miercke, L.J.W.7
Stroud, R.M.8
-
22
-
-
84949117636
-
A new gating site in human aquaporin-4: Insights from molecular dynamics simulations
-
[CrossRef] [PubMed]
-
Alberga, D.; Nicolotti, O.; Lattanzi, G.; Nicchia, G. P.; Frigeri, A.; Pisani, F.; Benfenati, V.; Mangiatordi, G. F. A new gating site in human aquaporin-4: Insights from molecular dynamics simulations. Biochim. Biophys. Acta 2014, 1838, 3052-3060. [CrossRef] [PubMed].
-
(2014)
Biochim. Biophys. Acta
, vol.1838
, pp. 3052-3060
-
-
Alberga, D.1
Nicolotti, O.2
Lattanzi, G.3
Nicchia, G.P.4
Frigeri, A.5
Pisani, F.6
Benfenati, V.7
Mangiatordi, G.F.8
-
23
-
-
0032526765
-
Isolation and functional analysis of alternative promoters in the human aquaporin-4 water channel gene
-
[CrossRef] [PubMed]
-
Umenishi, F.; Verkman, A. S. Isolation and functional analysis of alternative promoters in the human aquaporin-4 water channel gene. Genomics 1998, 50, 373-377. [CrossRef] [PubMed].
-
(1998)
Genomics
, vol.50
, pp. 373-377
-
-
Umenishi, F.1
Verkman, A.S.2
-
24
-
-
0029086229
-
CDNA cloning, gene organization, and chromosomal localization of a human mercurial insensitive water channel
-
[CrossRef] [PubMed]
-
Yang, B.; Ma, T.; Verkman, A. S. cDNA cloning, gene organization, and chromosomal localization of a human mercurial insensitive water channel. J. Biol. Chem. 1995, 270, 22907-22913. [CrossRef] [PubMed].
-
(1995)
J. Biol. Chem
, vol.270
, pp. 22907-22913
-
-
Yang, B.1
Ma, T.2
Verkman, A.S.3
-
25
-
-
0344430036
-
The molecular basis of water transport in the brain
-
[CrossRef] [PubMed]
-
Amiry-Moghaddam, M.; Ottersen, O. P. The molecular basis of water transport in the brain. Nat. Rev. Neurosci. 2003, 4, 991-1001. [CrossRef] [PubMed].
-
(2003)
Nat. Rev. Neurosci
, vol.4
, pp. 991-1001
-
-
Amiry-Moghaddam, M.1
Ottersen, O.P.2
-
26
-
-
0035906246
-
Regulation of aquaporin-4 expression in astrocytes
-
[CrossRef]
-
Yoneda, K.; Yamamoto, N.; Asai, K.; Sobue, K.; Fujita, Y.; Fujita, M.; Mase, M.; Yamada, K.; Nakanishi, M.; Tada, T.; et al. Regulation of aquaporin-4 expression in astrocytes. Brain Res. Mol. Brain Res. 2001, 89, 94-102. [CrossRef].
-
(2001)
Brain Res. Mol. Brain Res
, vol.89
, pp. 94-102
-
-
Yoneda, K.1
Yamamoto, N.2
Asai, K.3
Sobue, K.4
Fujita, Y.5
Fujita, M.6
Mase, M.7
Yamada, K.8
Nakanishi, M.9
Tada, T.10
-
27
-
-
82855165043
-
D184E mutation in aquaporin-4 gene impairs water permeability and links to deafness
-
[CrossRef] [PubMed]
-
Nicchia, G. P.; Ficarella, R.; Rossi, A.; Giangreco, I.; Nicolotti, O.; Carotti, A.; Pisani, F.; Estivill, X.; Gasparini, P.; Svelto, M.; et al. D184E mutation in aquaporin-4 gene impairs water permeability and links to deafness. Neuroscience 2011, 197, 80-88. [CrossRef] [PubMed].
-
(2011)
Neuroscience
, vol.197
, pp. 80-88
-
-
Nicchia, G.P.1
Ficarella, R.2
Rossi, A.3
Giangreco, I.4
Nicolotti, O.5
Carotti, A.6
Pisani, F.7
Estivill, X.8
Gasparini, P.9
Svelto, M.10
-
28
-
-
0035903098
-
Impaired hearing in mice lacking aquaporin-4 water channels
-
[CrossRef] [PubMed]
-
Li, J.; Verkman, A. S. Impaired hearing in mice lacking aquaporin-4 water channels. J. Biol. Chem. 2001, 276, 31233-31237. [CrossRef] [PubMed].
-
(2001)
J. Biol. Chem
, vol.276
, pp. 31233-31237
-
-
Li, J.1
Verkman, A.S.2
-
29
-
-
61449306769
-
Role of aquaporin-4 in cerebral edema and stroke
-
[PubMed]
-
Zador, Z.; Stiver, S.; Wang, V.; Manley, G. T. Role of aquaporin-4 in cerebral edema and stroke. Handb. Exp. Pharmacol. 2009, 190, 159-170. [PubMed].
-
(2009)
Handb. Exp. Pharmacol
, vol.190
, pp. 159-170
-
-
Zador, Z.1
Stiver, S.2
Wang, V.3
Manley, G.T.4
-
31
-
-
72549112818
-
Variants of the genes encoding AQP4 and Kir4. 1 are associated with subgroups of patients with temporal lobe epilepsy
-
[CrossRef] [PubMed]
-
Heuser, K.; Nagelhus, E. A.; Taubøll, E.; Indahl, U.; Berg, P. R.; Lien, S.; Nakken, S.; Gjerstad, L.; Ottersen, O. P. Variants of the genes encoding AQP4 and Kir4. 1 are associated with subgroups of patients with temporal lobe epilepsy. Epilepsy Res. 2010, 88, 55-64. [CrossRef] [PubMed].
-
(2010)
Epilepsy Res
, vol.88
, pp. 55-64
-
-
Heuser, K.1
Nagelhus, E.A.2
Taubøll, E.3
Indahl, U.4
Berg, P.R.5
Lien, S.6
Nakken, S.7
Gjerstad, L.8
Ottersen, O.P.9
-
32
-
-
0242577358
-
Administration of the soluble complement inhibitor, Crry-Ig, reduces inflammation and aquaporin 4 expression in lupus cerebritis
-
[CrossRef] [PubMed]
-
Alexander, J. J.; Bao, L.; Jacob, A.; Kraus, D. M.; Holers, V. M.; Quigg, R. J. Administration of the soluble complement inhibitor, Crry-Ig, reduces inflammation and aquaporin 4 expression in lupus cerebritis. Biochim. Biophys. Acta 2003, 1639, 169-176. [CrossRef] [PubMed].
-
(2003)
Biochim. Biophys. Acta
, vol.1639
, pp. 169-176
-
-
Alexander, J.J.1
Bao, L.2
Jacob, A.3
Kraus, D.M.4
Holers, V.M.5
Quigg, R.J.6
-
33
-
-
70349883885
-
Spinal cord lesions in patients with neuromyelitis optica: A retrospective long-term MRI follow-up study
-
[CrossRef] [PubMed]
-
Krampla, W.; Aboul-Enein, F.; Jecel, J.; Lang, W.; Fertl, E.; Hruby, W.; Kristoferitsch, W. Spinal cord lesions in patients with neuromyelitis optica: a retrospective long-term MRI follow-up study. Eur. Radiol. 2009, 19, 2535-2543. [CrossRef] [PubMed].
-
(2009)
Eur. Radiol
, vol.19
, pp. 2535-2543
-
-
Krampla, W.1
Aboul-Enein, F.2
Jecel, J.3
Lang, W.4
Fertl, E.5
Hruby, W.6
Kristoferitsch, W.7
-
34
-
-
33846907427
-
Identification of arylsulfonamides as Aquaporin 4 inhibitors
-
[CrossRef] [PubMed]
-
Huber, V. J.; Tsujita, M.; Yamazaki, M.; Sakimura, K.; Nakada, T. Identification of arylsulfonamides as Aquaporin 4 inhibitors. Bioorg. Med. Chem. Lett. 2007, 17, 1270-1273. [CrossRef] [PubMed].
-
(2007)
Bioorg. Med. Chem. Lett
, vol.17
, pp. 1270-1273
-
-
Huber, V.J.1
Tsujita, M.2
Yamazaki, M.3
Sakimura, K.4
Nakada, T.5
-
35
-
-
60649086355
-
Acetazolamide reversibly inhibits water conduction by aquaporin-4
-
[CrossRef] [PubMed]
-
Tanimura, Y.; Hiroaki, Y.; Fujiyoshi, Y. Acetazolamide reversibly inhibits water conduction by aquaporin-4. J. Struct. Biol. 2009, 166, 16-21. [CrossRef] [PubMed].
-
(2009)
J. Struct. Biol
, vol.166
, pp. 16-21
-
-
Tanimura, Y.1
Hiroaki, Y.2
Fujiyoshi, Y.3
-
36
-
-
79551579742
-
Pretreatment with a novel aquaporin 4 inhibitor, TGN-020, significantly reduces ischemic cerebral edema
-
[CrossRef] [PubMed]
-
Igarashi, H.; Huber, V. J.; Tsujita, M.; Nakada, T. Pretreatment with a novel aquaporin 4 inhibitor, TGN-020, significantly reduces ischemic cerebral edema. Neurol. Sci. 2011, 32, 113-116. [CrossRef] [PubMed].
-
(2011)
Neurol. Sci
, vol.32
, pp. 113-116
-
-
Igarashi, H.1
Huber, V.J.2
Tsujita, M.3
Nakada, T.4
-
37
-
-
57649199210
-
Identification of aquaporin 4 inhibitors using in vitro and in silico methods
-
[CrossRef] [PubMed]
-
Huber, V. J.; Tsujita, M.; Nakada, T. Identification of aquaporin 4 inhibitors using in vitro and in silico methods. Bioorg. Med. Chem. 2009, 17, 411-417. [CrossRef] [PubMed].
-
(2009)
Bioorg. Med. Chem
, vol.17
, pp. 411-417
-
-
Huber, V.J.1
Tsujita, M.2
Nakada, T.3
-
38
-
-
84860898728
-
Small-molecule inhibitors of NMO-IgG binding to aquaporin-4 reduce astrocyte cytotoxicity in neuromyelitis optica
-
[CrossRef] [PubMed]
-
Tradtrantip, L.; Zhang, H.; Anderson, M. O.; Saadoun, S.; Phuan, P.-W.; Papadopoulos, M. C.; Bennett, J. L.; Verkman, A. S. Small-molecule inhibitors of NMO-IgG binding to aquaporin-4 reduce astrocyte cytotoxicity in neuromyelitis optica. FASEB J. 2012, 26, 2197-2208. [CrossRef] [PubMed].
-
(2012)
FASEB J
, vol.26
, pp. 2197-2208
-
-
Tradtrantip, L.1
Zhang, H.2
Anderson, M.O.3
Saadoun, S.4
Phuan, P.-W.5
Papadopoulos, M.C.6
Bennett, J.L.7
Verkman, A.S.8
-
39
-
-
84908082962
-
Treatment of neuromyelitis optica: State-of-the-art and emerging therapies
-
[CrossRef] [PubMed]
-
Papadopoulos, M. C.; Bennett, J. L.; Verkman, A. S. Treatment of neuromyelitis optica: State-of-the-art and emerging therapies. Nat. Rev. Neurol. 2014, 10, 493-506. [CrossRef] [PubMed].
-
(2014)
Nat. Rev. Neurol
, vol.10
, pp. 493-506
-
-
Papadopoulos, M.C.1
Bennett, J.L.2
Verkman, A.S.3
-
40
-
-
11744384413
-
The Grotthuss mechanism
-
[CrossRef]
-
Agmon, N. The Grotthuss mechanism. Chem. Phys. Lett. 1995, 244, 456-462. [CrossRef].
-
(1995)
Chem. Phys. Lett
, vol.244
, pp. 456-462
-
-
Agmon, N.1
-
41
-
-
61449558400
-
Discovery of the aquaporins and development of the field
-
Beitz, P.D.E., Ed.; Springer: Berlin/Heidelberg, Germany
-
Carbrey, J. M.; Agre, P. Discovery of the aquaporins and development of the field. In Handbook of Experimental Pharmacology; Beitz, P. D. E., Ed.; Springer: Berlin/Heidelberg, Germany, 2009; Volume 190, pp. 3-28.
-
(2009)
Handbook of Experimental Pharmacology
, vol.190
, pp. 3-28
-
-
Carbrey, J.M.1
Agre, P.2
-
42
-
-
0033952945
-
Structure and function of aquaporin water channels
-
Verkman, A. S.; Mitra, A. K. Structure and function of aquaporin water channels. Am. J. Physiol. 2000, 278, F13-F28.
-
(2000)
Am. J. Physiol
, vol.278
, pp. F13-F28
-
-
Verkman, A.S.1
Mitra, A.K.2
-
43
-
-
0035979744
-
A refined structure of human aquaporin-1
-
[CrossRef]
-
De Groot, B. L.; Engel, A.; Grubmüller, H. A refined structure of human aquaporin-1. FEBS Lett. 2001, 504, 206-211. [CrossRef].
-
(2001)
FEBS Lett
, vol.504
, pp. 206-211
-
-
De Groot, B.L.1
Engel, A.2
Grubmüller, H.3
-
44
-
-
0035861454
-
Water permeation across biological membranes: Mechanism and dynamics of aquaporin-1 and GlpF
-
[CrossRef] [PubMed]
-
De Groot, B. L.; Grubmüller, H. Water permeation across biological membranes: Mechanism and dynamics of aquaporin-1 and GlpF. Science 2001, 294, 2353-2357. [CrossRef] [PubMed].
-
(2001)
Science
, vol.294
, pp. 2353-2357
-
-
De Groot, B.L.1
Grubmüller, H.2
-
45
-
-
0037134267
-
Control of the selectivity of the aquaporin water channel family by global orientational tuning
-
[CrossRef] [PubMed]
-
Tajkhorshid, E.; Nollert, P.; Jensen, M. Ø.; Miercke, L. J. W.; O'Connell, J.; Stroud, R. M.; Schulten, K. Control of the selectivity of the aquaporin water channel family by global orientational tuning. Science 2002, 296, 525-530. [CrossRef] [PubMed].
-
(2002)
Science
, vol.296
, pp. 525-530
-
-
Tajkhorshid, E.1
Nollert, P.2
Jensen, M.Ø.3
Miercke, L.J.W.4
O'Connell, J.5
Stroud, R.M.6
Schulten, K.7
-
46
-
-
4644308725
-
Structural determinants of proton blockage in aquaporins
-
[CrossRef] [PubMed]
-
Chakrabarti, N.; Roux, B.; Pomès, R. Structural determinants of proton blockage in aquaporins. J. Mol. Biol. 2004, 343, 493-510. [CrossRef] [PubMed].
-
(2004)
J. Mol. Biol
, vol.343
, pp. 493-510
-
-
Chakrabarti, N.1
Roux, B.2
Pomès, R.3
-
47
-
-
33646170424
-
Origins of proton transport behavior from selectivity domain mutations of the aquaporin-1 channel
-
[CrossRef] [PubMed]
-
Chen, H.; Wu, Y.; Voth, G. A. Origins of proton transport behavior from selectivity domain mutations of the aquaporin-1 channel. Biophys. J. 2006, 90, L73-L75. [CrossRef] [PubMed].
-
(2006)
Biophys. J
, vol.90
, pp. L73-L75
-
-
Chen, H.1
Wu, Y.2
Voth, G.A.3
-
48
-
-
84941131711
-
Structural insights into aquaporin selectivity and regulation
-
[CrossRef] [PubMed]
-
Kreida, S.; Törnroth-Horsefield, S. Structural insights into aquaporin selectivity and regulation. Curr. Opin. Struct. Biol. 2015, 33, 126-134. [CrossRef] [PubMed].
-
(2015)
Curr. Opin. Struct. Biol
, vol.33
, pp. 126-134
-
-
Kreida, S.1
Törnroth-Horsefield, S.2
-
49
-
-
84878943513
-
Subangstrom resolution X-ray structure details aquaporin-water interactions
-
[CrossRef] [PubMed]
-
Kosinska Eriksson, U.; Fischer, G.; Friemann, R.; Enkavi, G.; Tajkhorshid, E.; Neutze, R. Subangstrom resolution X-ray structure details aquaporin-water interactions. Science 2013, 340, 1346-1349. [CrossRef] [PubMed].
-
(2013)
Science
, vol.340
, pp. 1346-1349
-
-
Kosinska Eriksson, U.1
Fischer, G.2
Friemann, R.3
Enkavi, G.4
Tajkhorshid, E.5
Neutze, R.6
-
50
-
-
31044449089
-
Point mutations in the aromatic/arginine region in aquaporin 1 allow passage of urea, glycerol, ammonia, and protons
-
[CrossRef] [PubMed]
-
Beitz, E.; Wu, B.; Holm, L. M.; Schultz, J. E.; Zeuthen, T. Point mutations in the aromatic/arginine region in aquaporin 1 allow passage of urea, glycerol, ammonia, and protons. Proc. Natl. Acad. Sci. USA 2006, 103, 269-274. [CrossRef] [PubMed].
-
(2006)
Proc. Natl. Acad. Sci. USA
, vol.103
, pp. 269-274
-
-
Beitz, E.1
Wu, B.2
Holm, L.M.3
Schultz, J.E.4
Zeuthen, T.5
-
51
-
-
0027145628
-
The pore dimensions of gramicidin A
-
[CrossRef]
-
Smart, O. S.; Goodfellow, J. M.; Wallace, B. A. The pore dimensions of gramicidin A. Biophys. J. 1993, 65, 2455-2460. [CrossRef].
-
(1993)
Biophys. J
, vol.65
, pp. 2455-2460
-
-
Smart, O.S.1
Goodfellow, J.M.2
Wallace, B.A.3
-
52
-
-
80052627790
-
Water transport in human aquaporin-4: Molecular dynamics (MD) simulations
-
[CrossRef] [PubMed]
-
Cui, Y.; Bastien, D. A. Water transport in human aquaporin-4: Molecular dynamics (MD) simulations. Biochem. Biophys. Res. Commun. 2011, 412, 654-659. [CrossRef] [PubMed].
-
(2011)
Biochem. Biophys. Res. Commun
, vol.412
, pp. 654-659
-
-
Cui, Y.1
Bastien, D.A.2
-
53
-
-
0002174423
-
Steered molecular dynamics
-
Deuflhard, P., Hermans, J., Leimkuhler, B., Mark, A.E., Reich, S., Skeel, R.D., Eds.; Springer: Berlin/Heidelberg, Germany
-
Izrailev, S.; Stepaniants, S.; Isralewitz, B.; Kosztin, D.; Lu, H.; Molnar, F.; Wriggers, W.; Schulten, K. Steered molecular dynamics. In Computational Molecular Dynamics: Challenges, Methods, Ideas; Deuflhard, P., Hermans, J., Leimkuhler, B., Mark, A. E., Reich, S., Skeel, R. D., Eds.; Springer: Berlin/Heidelberg, Germany, 1999; pp. 39-65.
-
(1999)
Computational Molecular Dynamics: Challenges, Methods, Ideas
, pp. 39-65
-
-
Izrailev, S.1
Stepaniants, S.2
Isralewitz, B.3
Kosztin, D.4
Lu, H.5
Molnar, F.6
Wriggers, W.7
Schulten, K.8
-
54
-
-
0042325648
-
Brownian dynamics and the fluctuation-dissipation theorem
-
[CrossRef]
-
Bossis, G.; Quentrec, B.; Boon, J. P. Brownian dynamics and the fluctuation-dissipation theorem. Mol. Phys. 1982, 45, 191-196. [CrossRef].
-
(1982)
Mol. Phys
, vol.45
, pp. 191-196
-
-
Bossis, G.1
Quentrec, B.2
Boon, J.P.3
-
55
-
-
80052503022
-
Computational electrophysiology: The molecular dynamics of ion channel permeation and selectivity in atomistic detail
-
[CrossRef] [PubMed]
-
Kutzner, C.; Grubmüller, H.; de Groot, B. L.; Zachariae, U. Computational electrophysiology: the molecular dynamics of ion channel permeation and selectivity in atomistic detail. Biophys. J. 2011, 101, 809-817. [CrossRef] [PubMed].
-
(2011)
Biophys. J
, vol.101
, pp. 809-817
-
-
Kutzner, C.1
Grubmüller, H.2
de Groot, B.L.3
Zachariae, U.4
-
56
-
-
2342641537
-
Molecular basis of pH and Ca2+ regulation of aquaporin water permeability
-
[CrossRef] [PubMed]
-
Németh-Cahalan, K. L.; Kalman, K.; Hall, J. E. Molecular basis of pH and Ca2+ regulation of aquaporin water permeability. J. Gen. Physiol. 2004, 123, 573-580. [CrossRef] [PubMed].
-
(2004)
J. Gen. Physiol
, vol.123
, pp. 573-580
-
-
Németh-Cahalan, K.L.1
Kalman, K.2
Hall, J.E.3
-
57
-
-
0042531571
-
Nickel and extracellular acidification inhibit the water permeability of human aquaporin-3 in lung epithelial cells
-
[CrossRef] [PubMed]
-
Zelenina, M.; Bondar, A. A.; Zelenin, S.; Aperia, A. Nickel and extracellular acidification inhibit the water permeability of human aquaporin-3 in lung epithelial cells. J. Biol. Chem. 2003, 278, 30037-30043. [CrossRef] [PubMed].
-
(2003)
J. Biol. Chem
, vol.278
, pp. 30037-30043
-
-
Zelenina, M.1
Bondar, A.A.2
Zelenin, S.3
Aperia, A.4
-
58
-
-
10644251690
-
Copper inhibits the water and glycerol permeability of aquaporin-3
-
[CrossRef] [PubMed]
-
Zelenina, M.; Tritto, S.; Bondar, A. A.; Zelenin, S.; Aperia, A. Copper inhibits the water and glycerol permeability of aquaporin-3. J. Biol. Chem. 2004, 279, 51939-51943. [CrossRef] [PubMed].
-
(2004)
J. Biol. Chem
, vol.279
, pp. 51939-51943
-
-
Zelenina, M.1
Tritto, S.2
Bondar, A.A.3
Zelenin, S.4
Aperia, A.5
-
59
-
-
0037458556
-
A short regulatory domain restricts glycerol transport through yeast Fps1p
-
[CrossRef] [PubMed]
-
Tamás, M. J.; Karlgren, S.; Bill, R. M.; Hedfalk, K.; Allegri, L.; Ferreira, M.; Thevelein, J. M.; Rydström, J.; Mullins, J. G. L.; Hohmann, S. A short regulatory domain restricts glycerol transport through yeast Fps1p. J. Biol. Chem. 2003, 278, 6337-6345. [CrossRef] [PubMed].
-
(2003)
J. Biol. Chem
, vol.278
, pp. 6337-6345
-
-
Tamás, M.J.1
Karlgren, S.2
Bill, R.M.3
Hedfalk, K.4
Allegri, L.5
Ferreira, M.6
Thevelein, J.M.7
Rydström, J.8
Mullins, J.G.L.9
Hohmann, S.10
-
60
-
-
0030199138
-
The major integral proteins of spinach leaf plasma membranes are putative aquaporins and are phosphorylated in response to Ca2+ and apoplastic water potential
-
[CrossRef] [PubMed]
-
Johansson, I.; Larsson, C.; Ek, B.; Kjellbom, P. The major integral proteins of spinach leaf plasma membranes are putative aquaporins and are phosphorylated in response to Ca2+ and apoplastic water potential. Plant. Cell 1996, 8, 1181-1191. [CrossRef] [PubMed].
-
(1996)
Plant. Cell
, vol.8
, pp. 1181-1191
-
-
Johansson, I.1
Larsson, C.2
Ek, B.3
Kjellbom, P.4
-
61
-
-
0141484616
-
Cytosolic pH regulates root water transport during anoxic stress through gating of aquaporins
-
[CrossRef] [PubMed]
-
Tournaire-Roux, C.; Sutka, M.; Javot, H.; Gout, E.; Gerbeau, P.; Luu, D.-T.; Bligny, R.; Maurel, C. Cytosolic pH regulates root water transport during anoxic stress through gating of aquaporins. Nature 2003, 425, 393-397. [CrossRef] [PubMed].
-
(2003)
Nature
, vol.425
, pp. 393-397
-
-
Tournaire-Roux, C.1
Sutka, M.2
Javot, H.3
Gout, E.4
Gerbeau, P.5
Luu, D.-T.6
Bligny, R.7
Maurel, C.8
-
62
-
-
0036063016
-
Water permeability of aquaporin-4 is decreased by protein kinase C and dopamine
-
[CrossRef] [PubMed]
-
Zelenina, M.; Zelenin, S.; Bondar, A. A.; Brismar, H.; Aperia, A. Water permeability of aquaporin-4 is decreased by protein kinase C and dopamine. Am. J. Physiol. Ren. Physiol. 2002, 283, F309-F318. [CrossRef] [PubMed].
-
(2002)
Am. J. Physiol. Ren. Physiol
, vol.283
, pp. F309-F318
-
-
Zelenina, M.1
Zelenin, S.2
Bondar, A.A.3
Brismar, H.4
Aperia, A.5
-
63
-
-
45549097641
-
Identification of a molecular target for glutamate regulation of astrocyte water permeability
-
[CrossRef] [PubMed]
-
Gunnarson, E.; Zelenina, M.; Axehult, G.; Song, Y.; Bondar, A.; Krieger, P.; Brismar, H.; Zelenin, S.; Aperia, A. Identification of a molecular target for glutamate regulation of astrocyte water permeability. Glia 2008, 56, 587-596. [CrossRef] [PubMed].
-
(2008)
Glia
, vol.56
, pp. 587-596
-
-
Gunnarson, E.1
Zelenina, M.2
Axehult, G.3
Song, Y.4
Bondar, A.5
Krieger, P.6
Brismar, H.7
Zelenin, S.8
Aperia, A.9
-
64
-
-
84947215570
-
Control of the aquaporin-4 channel water permeability by structural dynamics of aromatic/arginine selectivity filter residues
-
[CrossRef] [PubMed]
-
Kitchen, P.; Conner, A. C. Control of the aquaporin-4 channel water permeability by structural dynamics of aromatic/arginine selectivity filter residues. Biochemistry 2015, 54, 6753-6755. [CrossRef] [PubMed].
-
(2015)
Biochemistry
, vol.54
, pp. 6753-6755
-
-
Kitchen, P.1
Conner, A.C.2
-
65
-
-
33748196115
-
Mechanism of gating and ion conductivity of a possible tetrameric pore in aquaporin-1
-
[CrossRef] [PubMed]
-
Yu, J.; Yool, A. J.; Schulten, K.; Tajkhorshid, E. Mechanism of gating and ion conductivity of a possible tetrameric pore in aquaporin-1. Structure 2006, 14, 1411-1423. [CrossRef] [PubMed].
-
(2006)
Structure
, vol.14
, pp. 1411-1423
-
-
Yu, J.1
Yool, A.J.2
Schulten, K.3
Tajkhorshid, E.4
-
66
-
-
62049084761
-
Structural and Functional Analysis of SoPIP2; 1 Mutants Adds Insight into Plant Aquaporin Gating
-
[CrossRef] [PubMed]
-
Nyblom, M.; Frick, A.; Wang, Y.; Ekvall, M.; Hallgren, K.; Hedfalk, K.; Neutze, R.; Tajkhorshid, E.; Törnroth-Horsefield, S. Structural and Functional Analysis of SoPIP2; 1 Mutants Adds Insight into Plant Aquaporin Gating. J. Mol. Biol. 2009, 387, 653-668. [CrossRef] [PubMed].
-
(2009)
J. Mol. Biol
, vol.387
, pp. 653-668
-
-
Nyblom, M.1
Frick, A.2
Wang, Y.3
Ekvall, M.4
Hallgren, K.5
Hedfalk, K.6
Neutze, R.7
Tajkhorshid, E.8
Törnroth-Horsefield, S.9
-
67
-
-
84875639205
-
The gating mechanism of the human aquaporin 5 revealed by molecular dynamics simulations
-
[CrossRef] [PubMed]
-
Janosi, L.; Ceccarelli, M. The gating mechanism of the human aquaporin 5 revealed by molecular dynamics simulations. PLoS ONE 2013, 8, e59897. [CrossRef] [PubMed].
-
(2013)
PLoS ONE
, vol.8
-
-
Janosi, L.1
Ceccarelli, M.2
-
68
-
-
34447325646
-
Water transport in aquaporins: Osmotic permeability matrix analysis of molecular dynamics simulations
-
[CrossRef] [PubMed]
-
Hashido, M.; Kidera, A.; Ikeguchi, M. Water transport in aquaporins: Osmotic permeability matrix analysis of molecular dynamics simulations. Biophys. J. 2007, 93, 373-385. [CrossRef] [PubMed].
-
(2007)
Biophys. J
, vol.93
, pp. 373-385
-
-
Hashido, M.1
Kidera, A.2
Ikeguchi, M.3
-
69
-
-
37249073324
-
Screening of matrix metalloproteinases available from the protein data bank: Insights into biological functions, domain organization, and zinc binding groups
-
[CrossRef] [PubMed]
-
Nicolotti, O.; Miscioscia, T. F.; Leonetti, F.; Muncipinto, G.; Carotti, A. Screening of matrix metalloproteinases available from the protein data bank: Insights into biological functions, domain organization, and zinc binding groups. J. Chem. Inf. Model. 2007, 47, 2439-2448. [CrossRef] [PubMed].
-
(2007)
J. Chem. Inf. Model
, vol.47
, pp. 2439-2448
-
-
Nicolotti, O.1
Miscioscia, T.F.2
Leonetti, F.3
Muncipinto, G.4
Carotti, A.5
-
70
-
-
0035794116
-
A single histidine residue determines the pH sensitivity of the pacemaker channel HCN2
-
[CrossRef] [PubMed]
-
Zong, X.; Stieber, J.; Ludwig, A.; Hofmann, F.; Biel, M. A single histidine residue determines the pH sensitivity of the pacemaker channel HCN2. J. Biol. Chem. 2001, 276, 6313-6319. [CrossRef] [PubMed].
-
(2001)
J. Biol. Chem
, vol.276
, pp. 6313-6319
-
-
Zong, X.1
Stieber, J.2
Ludwig, A.3
Hofmann, F.4
Biel, M.5
-
71
-
-
84919782921
-
Molecular aspects of structure, gating, and physiology of pH-sensitive background K2P and Kir K+-transport channels
-
[CrossRef] [PubMed]
-
Sepúlveda, F. V.; Pablo Cid, L.; Teulon, J.; Niemeyer, M. I. Molecular aspects of structure, gating, and physiology of pH-sensitive background K2P and Kir K+-transport channels. Physiol. Rev. 2015, 95, 179-217. [CrossRef] [PubMed].
-
(2015)
Physiol. Rev
, vol.95
, pp. 179-217
-
-
Sepúlveda, F.V.1
Pablo Cid, L.2
Teulon, J.3
Niemeyer, M.I.4
-
72
-
-
44349157807
-
Molecular mechanism of pH sensing in KcsA potassium channels
-
[CrossRef] [PubMed]
-
Thompson, A. N.; Posson, D. J.; Parsa, P. V.; Nimigean, C. M. Molecular mechanism of pH sensing in KcsA potassium channels. Proc. Natl. Acad. Sci. USA 2008, 105, 6900-6905. [CrossRef] [PubMed].
-
(2008)
Proc. Natl. Acad. Sci. USA
, vol.105
, pp. 6900-6905
-
-
Thompson, A.N.1
Posson, D.J.2
Parsa, P.V.3
Nimigean, C.M.4
-
73
-
-
84949227944
-
H95 is a pH-dependent gate in aquaporin 4
-
[CrossRef] [PubMed]
-
Kaptan, S.; Assentoft, M.; Schneider, H. P.; Fenton, R. A.; Deitmer, J. W.; MacAulay, N.; de Groot, B. L. H95 is a pH-dependent gate in aquaporin 4. Structures 2015, 23, 2309-2318. [CrossRef] [PubMed].
-
(2015)
Structures
, vol.23
, pp. 2309-2318
-
-
Kaptan, S.1
Assentoft, M.2
Schneider, H.P.3
Fenton, R.A.4
Deitmer, J.W.5
McAulay, N.6
de Groot, B.L.7
-
74
-
-
84865396279
-
Partial least-squares functional mode analysis: Application to the membrane proteins AQP1, Aqy1, and CLC-ec1
-
[CrossRef] [PubMed]
-
Krivobokova, T.; Briones, R.; Hub, J. S.; Munk, A.; de Groot, B. L. Partial least-squares functional mode analysis: Application to the membrane proteins AQP1, Aqy1, and CLC-ec1. Biophys. J. 2012, 103, 786-796. [CrossRef] [PubMed].
-
(2012)
Biophys. J
, vol.103
, pp. 786-796
-
-
Krivobokova, T.1
Briones, R.2
Hub, J.S.3
Munk, A.4
de Groot, B.L.5
-
75
-
-
37249032102
-
Dynamic personalities of proteins
-
[CrossRef] [PubMed]
-
Henzler-Wildman, K.; Kern, D. Dynamic personalities of proteins. Nature 2007, 450, 964-972. [CrossRef] [PubMed].
-
(2007)
Nature
, vol.450
, pp. 964-972
-
-
Henzler-Wildman, K.1
Kern, D.2
-
76
-
-
84872474093
-
Residue mutations and their impact on protein structure and function: Detecting beneficial and pathogenic changes
-
[CrossRef] [PubMed]
-
Studer, R. A.; Dessailly, B. H.; Orengo, C. A. Residue mutations and their impact on protein structure and function: detecting beneficial and pathogenic changes. Biochem. J. 2013, 449, 581-594. [CrossRef] [PubMed].
-
(2013)
Biochem. J
, vol.449
, pp. 581-594
-
-
Studer, R.A.1
Dessailly, B.H.2
Orengo, C.A.3
-
77
-
-
80051534540
-
A mutation in VPS35, encoding a subunit of the retromer complex, causes late-onset Parkinson disease
-
[CrossRef] [PubMed]
-
Zimprich, A.; Benet-Pagès, A.; Struhal, W.; Graf, E.; Eck, S. H.; Offman, M. N.; Haubenberger, D.; Spielberger, S.; Schulte, E. C.; Lichtner, P.; et al. A mutation in VPS35, encoding a subunit of the retromer complex, causes late-onset Parkinson disease. Am. J. Hum. Genet. 2011, 89, 168-175. [CrossRef] [PubMed].
-
(2011)
Am. J. Hum. Genet
, vol.89
, pp. 168-175
-
-
Zimprich, A.1
Benet-Pagès, A.2
Struhal, W.3
Graf, E.4
Eck, S.H.5
Offman, M.N.6
Haubenberger, D.7
Spielberger, S.8
Schulte, E.C.9
Lichtner, P.10
-
78
-
-
0035199471
-
Flexibility of the murine prion protein and its Asp178Asn mutant investigated by molecular dynamics simulations
-
[CrossRef]
-
Gsponer, J.; Ferrara, P.; Caflisch, A. Flexibility of the murine prion protein and its Asp178Asn mutant investigated by molecular dynamics simulations. J. Mol. Graph. Model. 2001, 20, 169-182. [CrossRef].
-
(2001)
J. Mol. Graph. Model
, vol.20
, pp. 169-182
-
-
Gsponer, J.1
Ferrara, P.2
Caflisch, A.3
-
79
-
-
16344380603
-
One gene, two diseases and three conformations: Molecular dynamics simulations of mutants of human prion protein at room temperature and elevated temperatures
-
[CrossRef] [PubMed]
-
Shamsir, M. S.; Dalby, A. R. One gene, two diseases and three conformations: Molecular dynamics simulations of mutants of human prion protein at room temperature and elevated temperatures. Proteins Struct. Funct. Bioinform. 2005, 59, 275-290. [CrossRef] [PubMed].
-
(2005)
Proteins Struct. Funct. Bioinform
, vol.59
, pp. 275-290
-
-
Shamsir, M.S.1
Dalby, A.R.2
-
80
-
-
84869989445
-
Screening of mutations affecting protein stability and dynamics of FGFR1-A simulation analysis
-
[CrossRef]
-
Doss, C. G. P.; Rajith, B.; Garwasis, N.; Mathew, P. R.; Raju, A. S.; Apoorva, K.; William, D.; Sadhana, N. R.; Himani, T.; Dike, I. Screening of mutations affecting protein stability and dynamics of FGFR1-A simulation analysis. Appl. Transl. Genom. 2012, 1, 37-43. [CrossRef].
-
(2012)
Appl. Transl. Genom
, vol.1
, pp. 37-43
-
-
Doss, C.G.P.1
Rajith, B.2
Garwasis, N.3
Mathew, P.R.4
Raju, A.S.5
Apoorva, K.6
William, D.7
Sadhana, N.R.8
Himani, T.9
Dike, I.10
-
81
-
-
0034859342
-
Molecular dynamics simulations of wild-type and mutant forms of the Mycobacterium tuberculosis MscL channel
-
[CrossRef]
-
Elmore, D. E.; Dougherty, D. A. Molecular dynamics simulations of wild-type and mutant forms of the Mycobacterium tuberculosis MscL channel. Biophys. J. 2001, 81, 1345-1359. [CrossRef].
-
(2001)
Biophys. J
, vol.81
, pp. 1345-1359
-
-
Elmore, D.E.1
Dougherty, D.A.2
-
82
-
-
79251630875
-
Insight into a novel p53 single point mutation (G389E) by molecular dynamics simulations
-
[CrossRef] [PubMed]
-
Pirolli, D.; Carelli Alinovi, C.; Capoluongo, E.; Satta, M. A.; Concolino, P.; Giardina, B.; de Rosa, M. C. Insight into a novel p53 single point mutation (G389E) by molecular dynamics simulations. Int. J. Mol. Sci. 2010, 12, 128-140. [CrossRef] [PubMed].
-
(2010)
Int. J. Mol. Sci
, vol.12
, pp. 128-140
-
-
Pirolli, D.1
Carelli Alinovi, C.2
Capoluongo, E.3
Satta, M.A.4
Concolino, P.5
Giardina, B.6
de Rosa, M.C.7
-
83
-
-
84941584557
-
ClC-1 mutations in myotonia congenita patients: Insights into molecular gating mechanisms and genotype-phenotype correlation
-
[CrossRef] [PubMed]
-
Imbrici, P.; Maggi, L.; Mangiatordi, G. F.; Dinardo, M. M.; Altamura, C.; Brugnoni, R.; Alberga, D.; Pinter, G. L.; Ricci, G.; Siciliano, G.; et al. ClC-1 mutations in myotonia congenita patients: insights into molecular gating mechanisms and genotype-phenotype correlation. J. Physiol. 2015, 593, 4181-4199. [CrossRef] [PubMed].
-
(2015)
J. Physiol
, vol.593
, pp. 4181-4199
-
-
Imbrici, P.1
Maggi, L.2
Mangiatordi, G.F.3
Dinardo, M.M.4
Altamura, C.5
Brugnoni, R.6
Alberga, D.7
Pinter, G.L.8
Ricci, G.9
Siciliano, G.10
-
84
-
-
1842301081
-
Molecular modeling-guided mutagenesis of the extracellular part of gp130 leads to the identification of contact sites in the interleukin-6 (IL-6)α IL-6 receptor gp130 Complex
-
[CrossRef] [PubMed]
-
Horsten, U.; Müller-Newen, G.; Gerhartz, C.; Wollmer, A.; Wijdenes, J.; Heinrich, P. C.; Grötzinger, J. Molecular modeling-guided mutagenesis of the extracellular part of gp130 leads to the identification of contact sites in the interleukin-6 (IL-6)α IL-6 receptor gp130 Complex. J. Biol. Chem. 1997, 272, 23748-23757. [CrossRef] [PubMed].
-
(1997)
J. Biol. Chem
, vol.272
, pp. 23748-23757
-
-
Horsten, U.1
Müller-Newen, G.2
Gerhartz, C.3
Wollmer, A.4
Wijdenes, J.5
Heinrich, P.C.6
Grötzinger, J.7
-
85
-
-
33845985993
-
Molecular modeling-guided site-directed mutagenesis of cytochrome P450 2D6
-
[CrossRef] [PubMed]
-
De Graaf, C.; Oostenbrink, C.; Keizers, P. H.; van Vugt-Lussenburg, B. M.; van Waterschoot, R. A.; Tschirret-Guth, R. A.; Commandeur, J. N.; Vermeulen, N. P. Molecular modeling-guided site-directed mutagenesis of cytochrome P450 2D6. Curr. Drug Metab. 2007, 8, 59-77. [CrossRef] [PubMed].
-
(2007)
Curr. Drug Metab
, vol.8
, pp. 59-77
-
-
De Graaf, C.1
Oostenbrink, C.2
Keizers, P.H.3
van Vugt-Lussenburg, B.M.4
van Waterschoot, R.A.5
Tschirret-Guth, R.A.6
Commandeur, J.N.7
Vermeulen, N.P.8
-
86
-
-
77649273913
-
Model-guided mutagenesis drives functional studies of human NHA2, implicated in hypertension
-
[CrossRef] [PubMed]
-
Schushan, M.; Xiang, M.; Bogomiakov, P.; Padan, E.; Rao, R.; Ben-Tal, N. Model-guided mutagenesis drives functional studies of human NHA2, implicated in hypertension. J. Mol. Biol. 2010, 396, 1181-1196. [CrossRef] [PubMed].
-
(2010)
J. Mol. Biol
, vol.396
, pp. 1181-1196
-
-
Schushan, M.1
Xiang, M.2
Bogomiakov, P.3
Padan, E.4
Rao, R.5
Ben-Tal, N.6
-
87
-
-
0031030586
-
Prostacyclin synthase active sites identification by molecular modeling-guided site-directed mutagenesis
-
[CrossRef] [PubMed]
-
Shyue, S.-K.; Ruan, K.-H.; Wang, L.-H.; Wu, K. K. Prostacyclin synthase active sites identification by molecular modeling-guided site-directed mutagenesis. J. Biol. Chem. 1997, 272, 3657-3662. [CrossRef] [PubMed].
-
(1997)
J. Biol. Chem
, vol.272
, pp. 3657-3662
-
-
Shyue, S.-K.1
Ruan, K.-H.2
Wang, L.-H.3
Wu, K.K.4
-
88
-
-
0029664951
-
Identification of thromboxane A2 synthase active site residues by molecular modeling-guided site-directed mutagenesis
-
[CrossRef] [PubMed]
-
Wang, L.-H.; Matijevic-Aleksic, N.; Hsu, P.-Y.; Ruan, K.-H.; Wu, K. K.; Kulmacz, R. J. Identification of thromboxane A2 synthase active site residues by molecular modeling-guided site-directed mutagenesis. J. Biol. Chem. 1996, 271, 19970-19975. [CrossRef] [PubMed].
-
(1996)
J. Biol. Chem
, vol.271
, pp. 19970-19975
-
-
Wang, L.-H.1
Matijevic-Aleksic, N.2
Hsu, P.-Y.3
Ruan, K.-H.4
Wu, K.K.5
Kulmacz, R.J.6
-
89
-
-
0036310181
-
A role for humoral mechanisms in the pathogenesis of Devic's neuromyelitis optica
-
[CrossRef] [PubMed]
-
Lucchinetti, C. F.; Mandler, R. N.; McGavern, D.; Bruck, W.; Gleich, G.; Ransohoff, R. M.; Trebst, C.; Weinshenker, B.; Wingerchuk, D.; Parisi, J. E.; et al. A role for humoral mechanisms in the pathogenesis of Devic's neuromyelitis optica. Brain 2002, 125, 1450-1461. [CrossRef] [PubMed].
-
(2002)
Brain
, vol.125
, pp. 1450-1461
-
-
Lucchinetti, C.F.1
Mandler, R.N.2
McGavern, D.3
Bruck, W.4
Gleich, G.5
Ransohoff, R.M.6
Trebst, C.7
Weinshenker, B.8
Wingerchuk, D.9
Parisi, J.E.10
-
90
-
-
81255134154
-
Autoimmunity in neuromyelitis optica and opticospinal multiple sclerosis: Astrocytopathy as a common denominator in demyelinating disorders
-
[CrossRef] [PubMed]
-
Kira, J. Autoimmunity in neuromyelitis optica and opticospinal multiple sclerosis: Astrocytopathy as a common denominator in demyelinating disorders. J. Neurol. Sci. 2011, 311, 69-77. [CrossRef] [PubMed].
-
(2011)
J. Neurol. Sci
, vol.311
, pp. 69-77
-
-
Kira, J.1
-
91
-
-
84861138201
-
Aquaporin 4 and neuromyelitis optica
-
[CrossRef]
-
Papadopoulos, M. C.; Verkman, A. S. Aquaporin 4 and neuromyelitis optica. Lancet Neurol. 2012, 11, 535-544. [CrossRef].
-
(2012)
Lancet Neurol
, vol.11
, pp. 535-544
-
-
Papadopoulos, M.C.1
Verkman, A.S.2
-
92
-
-
79953225158
-
Identification of two major conformational aquaporin-4 epitopes for neuromyelitis optica autoantibody binding
-
[CrossRef] [PubMed]
-
Pisani, F.; Mastrototaro, M.; Rossi, A.; Nicchia, G. P.; Tortorella, C.; Ruggieri, M.; Trojano, M.; Frigeri, A.; Svelto, M. Identification of two major conformational aquaporin-4 epitopes for neuromyelitis optica autoantibody binding. J. Biol. Chem. 2011, 286, 9216-9224. [CrossRef] [PubMed].
-
(2011)
J. Biol. Chem
, vol.286
, pp. 9216-9224
-
-
Pisani, F.1
Mastrototaro, M.2
Rossi, A.3
Nicchia, G.P.4
Tortorella, C.5
Ruggieri, M.6
Trojano, M.7
Frigeri, A.8
Svelto, M.9
-
93
-
-
83255193926
-
Post-golgi supramolecular assembly of aquaporin-4 in orthogonal arrays
-
[CrossRef] [PubMed]
-
Rossi, A.; Baumgart, F.; van Hoek, A. N.; Verkman, A. S. Post-golgi supramolecular assembly of aquaporin-4 in orthogonal arrays. Traffic 2012, 13, 43-53. [CrossRef] [PubMed].
-
(2012)
Traffic
, vol.13
, pp. 43-53
-
-
Rossi, A.1
Baumgart, F.2
van Hoek, A.N.3
Verkman, A.S.4
-
94
-
-
70349122106
-
Aquaporin-4 orthogonal arrays of particles are the target for neuromyelitis optica autoantibodies
-
[CrossRef] [PubMed]
-
Nicchia, G. P.; Mastrototaro, M.; Rossi, A.; Pisani, F.; Tortorella, C.; Ruggieri, M.; Lia, A.; Trojano, M.; Frigeri, A.; Svelto, M. Aquaporin-4 orthogonal arrays of particles are the target for neuromyelitis optica autoantibodies. Glia 2009, 57, 1363-1373. [CrossRef] [PubMed].
-
(2009)
Glia
, vol.57
, pp. 1363-1373
-
-
Nicchia, G.P.1
Mastrototaro, M.2
Rossi, A.3
Pisani, F.4
Tortorella, C.5
Ruggieri, M.6
Lia, A.7
Trojano, M.8
Frigeri, A.9
Svelto, M.10
-
95
-
-
84908626208
-
Identification of a point mutation impairing the binding between aquaporin-4 and neuromyelitis optica autoantibodies
-
[CrossRef] [PubMed]
-
Pisani, F.; Mola, M. G.; Simone, L.; Rosito, S.; Alberga, D.; Mangiatordi, G. F.; Lattanzi, G.; Nicolotti, O.; Frigeri, A.; Svelto, M.; et al. Identification of a point mutation impairing the binding between aquaporin-4 and neuromyelitis optica autoantibodies. J. Biol. Chem. 2014, 289, 30578-30589. [CrossRef] [PubMed].
-
(2014)
J. Biol. Chem
, vol.289
, pp. 30578-30589
-
-
Pisani, F.1
Mola, M.G.2
Simone, L.3
Rosito, S.4
Alberga, D.5
Mangiatordi, G.F.6
Lattanzi, G.7
Nicolotti, O.8
Frigeri, A.9
Svelto, M.10
-
96
-
-
84927534660
-
Challenging AQP4 druggability for NMO-IgG antibody binding using molecular dynamics and molecular interaction fields
-
[CrossRef] [PubMed]
-
Mangiatordi, G. F.; Alberga, D.; Siragusa, L.; Goracci, L.; Lattanzi, G.; Nicolotti, O. Challenging AQP4 druggability for NMO-IgG antibody binding using molecular dynamics and molecular interaction fields. Biochim. Biophys. Acta 2015, 1848, 1462-1471. [CrossRef] [PubMed].
-
(2015)
Biochim. Biophys. Acta
, vol.1848
, pp. 1462-1471
-
-
Mangiatordi, G.F.1
Alberga, D.2
Siragusa, L.3
Goracci, L.4
Lattanzi, G.5
Nicolotti, O.6
-
97
-
-
69349101503
-
Quantifying uncertainty and sampling quality in biomolecular simulations
-
[PubMed]
-
Grossfield, A.; Zuckerman, D. M. Quantifying uncertainty and sampling quality in biomolecular simulations. Annu. Rep. Comput. Chem. 2009, 5, 23-48. [PubMed].
-
(2009)
Annu. Rep. Comput. Chem
, vol.5
, pp. 23-48
-
-
Grossfield, A.1
Zuckerman, D.M.2
-
98
-
-
33746071900
-
A practical view of 1druggability1
-
[CrossRef] [PubMed]
-
Keller, T. H.; Pichota, A.; Yin, Z. A practical view of 1druggability1. Curr. Opin. Chem. Biol. 2006, 10, 357-361. [CrossRef] [PubMed].
-
(2006)
Curr. Opin. Chem. Biol
, vol.10
, pp. 357-361
-
-
Keller, T.H.1
Pichota, A.2
Yin, Z.3
-
99
-
-
84898596733
-
Aquaporins: Important but elusive drug targets
-
[CrossRef] [PubMed]
-
Verkman, A. S.; Anderson, M. O.; Papadopoulos, M. C. Aquaporins: Important but elusive drug targets. Nat. Rev. Drug Discov. 2014, 13, 259-277. [CrossRef] [PubMed].
-
(2014)
Nat. Rev. Drug Discov
, vol.13
, pp. 259-277
-
-
Verkman, A.S.1
Anderson, M.O.2
Papadopoulos, M.C.3
-
100
-
-
79951967029
-
Principles of early drug discovery
-
[CrossRef] [PubMed]
-
Hughes, J.; Rees, S.; Kalindjian, S.; Philpott, K. Principles of early drug discovery. Br. J. Pharmacol. 2011, 162, 1239-1249. [CrossRef] [PubMed].
-
(2011)
Br. J. Pharmacol
, vol.162
, pp. 1239-1249
-
-
Hughes, J.1
Rees, S.2
Kalindjian, S.3
Philpott, K.4
-
101
-
-
77955397914
-
Understanding and predicting druggability. A high-throughput method for detection of drug binding sites
-
[CrossRef] [PubMed]
-
Schmidtke, P.; Barril, X. Understanding and predicting druggability. A high-throughput method for detection of drug binding sites. J. Med. Chem. 2010, 53, 5858-5867. [CrossRef] [PubMed].
-
(2010)
J. Med. Chem
, vol.53
, pp. 5858-5867
-
-
Schmidtke, P.1
Barril, X.2
-
102
-
-
84979862178
-
PockDrug-Server: A new web server for predicting pocket druggability on holo and apo proteins
-
[CrossRef] [PubMed]
-
Hussein, H. A.; Borrel, A.; Geneix, C.; Petitjean, M.; Regad, L.; Camproux, A.-C. PockDrug-Server: A new web server for predicting pocket druggability on holo and apo proteins. Nucleic Acids Res. 2015. [CrossRef] [PubMed].
-
(2015)
Nucleic Acids Res
-
-
Hussein, H.A.1
Borrel, A.2
Geneix, C.3
Petitjean, M.4
Regad, L.5
Camproux, A.-C.6
-
103
-
-
79953703975
-
Fragment screening to predict druggability (ligandability) and lead discovery success
-
[CrossRef] [PubMed]
-
Edfeldt, F. N. B.; Folmer, R. H. A.; Breeze, A. L. Fragment screening to predict druggability (ligandability) and lead discovery success. Drug Discov. Today 2011, 16, 284-287. [CrossRef] [PubMed].
-
(2011)
Drug Discov. Today
, vol.16
, pp. 284-287
-
-
Edfeldt, F.N.B.1
Folmer, R.H.A.2
Breeze, A.L.3
-
104
-
-
84953257885
-
Prediction of druggable proteins using machine learning and systems biology: A mini-review
-
[CrossRef] [PubMed]
-
Kandoi, G.; Acencio, M. L.; Lemke, N. Prediction of druggable proteins using machine learning and systems biology: A mini-review. Syst. Biol. 2015, 6, 366. [CrossRef] [PubMed].
-
(2015)
Syst. Biol
, vol.6
-
-
Kandoi, G.1
Acencio, M.L.2
Lemke, N.3
-
105
-
-
84946216702
-
New frontiers in druggability
-
[CrossRef] [PubMed]
-
Kozakov, D.; Hall, D. R.; Napoleon, R. L.; Yueh, C.; Whitty, A.; Vajda, S. New frontiers in druggability. J. Med. Chem. 2015, 58, 9063-9088. [CrossRef] [PubMed].
-
(2015)
J. Med. Chem
, vol.58
, pp. 9063-9088
-
-
Kozakov, D.1
Hall, D.R.2
Napoleon, R.L.3
Yueh, C.4
Whitty, A.5
Vajda, S.6
-
106
-
-
0033800498
-
VolSurf: A new tool for the pharmacokinetic optimization of lead compounds
-
[CrossRef]
-
Cruciani, G.; Pastor, M.; Guba, W. VolSurf: A new tool for the pharmacokinetic optimization of lead compounds. Eur. J. Pharm. Sci. 2000, 11 (Suppl. S2), S29-S39. [CrossRef].
-
(2000)
Eur. J. Pharm. Sci
, vol.11
, pp. S29-S39
-
-
Cruciani, G.1
Pastor, M.2
Guba, W.3
-
107
-
-
76649139794
-
Computational approaches to identifying and characterizing protein binding sites for ligand design
-
[CrossRef] [PubMed]
-
Henrich, S.; Salo-Ahen, O. M. H.; Huang, B.; Rippmann, F. F.; Cruciani, G.; Wade, R. C. Computational approaches to identifying and characterizing protein binding sites for ligand design. J. Mol. Recognit. 2010, 23, 209-219. [CrossRef] [PubMed].
-
(2010)
J. Mol. Recognit
, vol.23
, pp. 209-219
-
-
Henrich, S.1
Salo-Ahen, O.M.H.2
Huang, B.3
Rippmann, F.F.4
Cruciani, G.5
Wade, R.C.6
-
108
-
-
84877651696
-
Ligand-, structure-and pharmacophore-based molecular fingerprints: A case study on adenosine A1, A2A, A2B, and A3 receptor antagonists
-
[CrossRef] [PubMed]
-
Sirci, F.; Goracci, L.; Rodríguez, D.; van Muijlwijk-Koezen, J.; Gutiérrez-de-Terán, H.; Mannhold, R. Ligand-, structure-and pharmacophore-based molecular fingerprints: A case study on adenosine A1, A2A, A2B, and A3 receptor antagonists. J. Comput. Aided Mol. Des. 2012, 26, 1247-1266. [CrossRef] [PubMed].
-
(2012)
J. Comput. Aided Mol. Des
, vol.26
, pp. 1247-1266
-
-
Sirci, F.1
Goracci, L.2
Rodríguez, D.3
van Muijlwijk-Koezen, J.4
Gutiérrez-de-Terán, H.5
Mannhold, R.6
-
109
-
-
0021871375
-
A computational procedure for determining energetically favorable binding sites on biologically important macromolecules
-
[CrossRef] [PubMed]
-
Goodford, P. J. A computational procedure for determining energetically favorable binding sites on biologically important macromolecules. J. Med. Chem. 1985, 28, 849-857. [CrossRef] [PubMed].
-
(1985)
J. Med. Chem
, vol.28
, pp. 849-857
-
-
Goodford, P.J.1
-
110
-
-
33846155913
-
Structure-based maximal affinity model predicts small-molecule druggability
-
[CrossRef] [PubMed]
-
Cheng, A. C.; Coleman, R. G.; Smyth, K. T.; Cao, Q.; Soulard, P.; Caffrey, D. R.; Salzberg, A. C.; Huang, E. S. Structure-based maximal affinity model predicts small-molecule druggability. Nat. Biotechnol. 2007, 25, 71-75. [CrossRef] [PubMed].
-
(2007)
Nat. Biotechnol
, vol.25
, pp. 71-75
-
-
Cheng, A.C.1
Coleman, R.G.2
Smyth, K.T.3
Cao, Q.4
Soulard, P.5
Caffrey, D.R.6
Salzberg, A.C.7
Huang, E.S.8
-
111
-
-
79952576448
-
Structure and functions of aquaporin-4-based orthogonal arrays of particles
-
[PubMed]
-
Wolburg, H.; Wolburg-Buchholz, K.; Fallier-Becker, P.; Noell, S.; Mack, A. F. Structure and functions of aquaporin-4-based orthogonal arrays of particles. Int. Rev. Cell. Mol. Biol. 2011, 287, 1-41. [PubMed].
-
(2011)
Int. Rev. Cell. Mol. Biol
, vol.287
, pp. 1-41
-
-
Wolburg, H.1
Wolburg-Buchholz, K.2
Fallier-Becker, P.3
Noell, S.4
Mack, A.F.5
-
112
-
-
72549119219
-
Reversible, temperature-dependent supramolecular assembly of aquaporin-4 orthogonal arrays in live cell membranes
-
[CrossRef] [PubMed]
-
Crane, J. M.; Verkman, A. S. Reversible, temperature-dependent supramolecular assembly of aquaporin-4 orthogonal arrays in live cell membranes. Biophys. J. 2009, 97, 3010-3018. [CrossRef] [PubMed].
-
(2009)
Biophys. J
, vol.97
, pp. 3010-3018
-
-
Crane, J.M.1
Verkman, A.S.2
-
113
-
-
25444481354
-
Replica exchange with solute tempering: A method for sampling biological systems in explicit water
-
[CrossRef] [PubMed]
-
Liu, P.; Kim, B.; Friesner, R. A.; Berne, B. J. Replica exchange with solute tempering: A method for sampling biological systems in explicit water. Proc. Natl. Acad. Sci. USA 2005, 102, 13749-13754. [CrossRef] [PubMed].
-
(2005)
Proc. Natl. Acad. Sci. USA
, vol.102
, pp. 13749-13754
-
-
Liu, P.1
Kim, B.2
Friesner, R.A.3
Berne, B.J.4
-
114
-
-
11144323163
-
Virtual screening of chemical libraries
-
[CrossRef] [PubMed]
-
Shoichet, B. K. Virtual screening of chemical libraries. Nature 2004, 432, 862-865. [CrossRef] [PubMed].
-
(2004)
Nature
, vol.432
, pp. 862-865
-
-
Shoichet, B.K.1
-
115
-
-
8844263008
-
Docking and scoring in virtual screening for drug discovery: Methods and applications
-
[CrossRef] [PubMed]
-
Kitchen, D. B.; Decornez, H.; Furr, J. R.; Bajorath, J. Docking and scoring in virtual screening for drug discovery: Methods and applications. Nat. Rev. Drug Discov. 2004, 3, 935-949. [CrossRef] [PubMed].
-
(2004)
Nat. Rev. Drug Discov
, vol.3
, pp. 935-949
-
-
Kitchen, D.B.1
Decornez, H.2
Furr, J.R.3
Bajorath, J.4
-
116
-
-
79956024935
-
State-of-the-art in ligand-based virtual screening
-
[CrossRef] [PubMed]
-
Ripphausen, P.; Nisius, B.; Bajorath, J. State-of-the-art in ligand-based virtual screening. Drug Discov. Today 2011, 16, 372-376. [CrossRef] [PubMed].
-
(2011)
Drug Discov. Today
, vol.16
, pp. 372-376
-
-
Ripphausen, P.1
Nisius, B.2
Bajorath, J.3
-
117
-
-
33744551693
-
Structure-based virtual screening of chemical libraries for drug discovery
-
[CrossRef] [PubMed]
-
Ghosh, S.; Nie, A.; An, J.; Huang, Z. Structure-based virtual screening of chemical libraries for drug discovery. Curr. Opin. Chem. Biol. 2006, 10, 194-202. [CrossRef] [PubMed].
-
(2006)
Curr. Opin. Chem. Biol
, vol.10
, pp. 194-202
-
-
Ghosh, S.1
Nie, A.2
An, J.3
Huang, Z.4
-
118
-
-
84905454868
-
Structure-based druggability assessment of the mammalian structural proteome with inclusion of light protein flexibility
-
[CrossRef] [PubMed]
-
Loving, K. A.; Lin, A.; Cheng, A. C. Structure-based druggability assessment of the mammalian structural proteome with inclusion of light protein flexibility. PLoS Comput. Biol. 2014, 10, e1003741. [CrossRef] [PubMed].
-
(2014)
PLoS Comput. Biol
, vol.10
-
-
Loving, K.A.1
Lin, A.2
Cheng, A.C.3
-
119
-
-
56449127496
-
Fully automated molecular mechanics based induced fit protein-ligand docking method
-
[CrossRef] [PubMed]
-
Koska, J.; Spassov, V. Z.; Maynard, A. J.; Yan, L.; Austin, N.; Flook, P. K.; Venkatachalam, C. M. Fully automated molecular mechanics based induced fit protein-ligand docking method. J. Chem. Inf. Model. 2008, 48, 1965-1973. [CrossRef] [PubMed].
-
(2008)
J. Chem. Inf. Model
, vol.48
, pp. 1965-1973
-
-
Koska, J.1
Spassov, V.Z.2
Maynard, A.J.3
Yan, L.4
Austin, N.5
Flook, P.K.6
Venkatachalam, C.M.7
-
120
-
-
84896948347
-
BP-Dock: A flexible docking scheme for exploring protein-ligand interactions based on unbound structures
-
[CrossRef] [PubMed]
-
Bolia, A.; Gerek, Z. N.; Ozkan, S. B. BP-Dock: A flexible docking scheme for exploring protein-ligand interactions based on unbound structures. J. Chem. Inf. Model. 2014, 54, 913-925. [CrossRef] [PubMed].
-
(2014)
J. Chem. Inf. Model
, vol.54
, pp. 913-925
-
-
Bolia, A.1
Gerek, Z.N.2
Ozkan, S.B.3
-
121
-
-
84862233340
-
Drug repurposing from an academic perspective
-
[CrossRef] [PubMed]
-
Oprea, T. I.; Bauman, J. E.; Bologa, C. G.; Buranda, T.; Chigaev, A.; Edwards, B. S.; Jarvik, J. W.; Gresham, H. D.; Haynes, M. K.; Hjelle, B.; et al. Drug repurposing from an academic perspective. Drug Discov. Today Ther. Strateg. 2011, 8, 61-69. [CrossRef] [PubMed].
-
(2011)
Drug Discov. Today Ther. Strateg
, vol.8
, pp. 61-69
-
-
Oprea, T.I.1
Bauman, J.E.2
Bologa, C.G.3
Buranda, T.4
Chigaev, A.5
Edwards, B.S.6
Jarvik, J.W.7
Gresham, H.D.8
Haynes, M.K.9
Hjelle, B.10
-
122
-
-
38449111448
-
The role of thalidomide in the management of erythema nodosum leprosum
-
[PubMed]
-
Walker, S. L.; Waters, M. F. R.; Lockwood, D. N. J. The role of thalidomide in the management of erythema nodosum leprosum. Lepr. Rev. 2007, 78, 197-215. [PubMed].
-
(2007)
Lepr. Rev
, vol.78
, pp. 197-215
-
-
Walker, S.L.1
Waters, M.F.R.2
Lockwood, D.N.J.3
-
123
-
-
0030154874
-
Sildenafil: An orally active type 5 cyclic GMP-specific phosphodiesterase inhibitor for the treatment of penile erectile dysfunction
-
Boolell, M.; Allen, M. J.; Ballard, S. A.; Gepi-Attee, S.; Muirhead, G. J.; Naylor, A. M.; Osterloh, I. H.; Gingell, C. Sildenafil: An orally active type 5 cyclic GMP-specific phosphodiesterase inhibitor for the treatment of penile erectile dysfunction. Int. J. Impot. Res. 1996, 8, 47-52.
-
(1996)
Int. J. Impot. Res
, vol.8
, pp. 47-52
-
-
Boolell, M.1
Allen, M.J.2
Ballard, S.A.3
Gepi-Attee, S.4
Muirhead, G.J.5
Naylor, A.M.6
Osterloh, I.H.7
Gingell, C.8
-
124
-
-
65649112521
-
The value of drug repositioning in the current pharmaceutical market
-
[CrossRef] [PubMed]
-
Tobinick, E. L. The value of drug repositioning in the current pharmaceutical market. Drug News Perspect. 2009, 22, 119-125. [CrossRef] [PubMed].
-
(2009)
Drug News Perspect
, vol.22
, pp. 119-125
-
-
Tobinick, E.L.1
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