-
2
-
-
22844452064
-
The effects of parabens on the mechanosensitive channels of E. coli.
-
Nguyen T., Clare B., Guo W., and Martinac B. The effects of parabens on the mechanosensitive channels of E. coli. Eur. Biophys. J. 34 (2005) 389-395
-
(2005)
Eur. Biophys. J.
, vol.34
, pp. 389-395
-
-
Nguyen, T.1
Clare, B.2
Guo, W.3
Martinac, B.4
-
3
-
-
21244495660
-
Propyl paraben induces potassium efflux in Escherichia coli
-
Bredin J., Davin-Régli A., and Pagés J.M. Propyl paraben induces potassium efflux in Escherichia coli. J. Antimicrob. Chemother. 55 (2005) 1013-1015
-
(2005)
J. Antimicrob. Chemother.
, vol.55
, pp. 1013-1015
-
-
Bredin, J.1
Davin-Régli, A.2
Pagés, J.M.3
-
4
-
-
0032210957
-
Some alkyl hydroxy benzoate preservatives (Parabens) are estrogenic
-
Routledge E.J., Parker J., Odum J., Ashby J., and Sumpter J.P. Some alkyl hydroxy benzoate preservatives (Parabens) are estrogenic. Toxicol. Appl. Pharmcol. 153 (1998) 12-19
-
(1998)
Toxicol. Appl. Pharmcol.
, vol.153
, pp. 12-19
-
-
Routledge, E.J.1
Parker, J.2
Odum, J.3
Ashby, J.4
Sumpter, J.P.5
-
5
-
-
0030667676
-
Molecular Basis of agonism and antagonism in the oestrigen receptor
-
Brzozowski A.M., Pike A.C.-W., Dauter Z., Hubbard R.E., Bonn T., Engström O., Öhman L., Greene G.L., Gustafsson J.A.-, and Carlquist M. Molecular Basis of agonism and antagonism in the oestrigen receptor. Nature 389 (1997) 753-758
-
(1997)
Nature
, vol.389
, pp. 753-758
-
-
Brzozowski, A.M.1
Pike, A.C.-W.2
Dauter, Z.3
Hubbard, R.E.4
Bonn, T.5
Engström, O.6
Öhman, L.7
Greene, G.L.8
Gustafsson J.A.-9
Carlquist, M.10
-
6
-
-
0027483754
-
Medical hypothesis: Xenoestrogens as preventable causes of breast cancer
-
Davis D.L., Bradlow H.L., Wolff M., Woodruff T., Hoel D.G., and Culver H.A. Medical hypothesis: Xenoestrogens as preventable causes of breast cancer. Environ. Health Perspect. 101 (1993) 378-384
-
(1993)
Environ. Health Perspect.
, vol.101
, pp. 378-384
-
-
Davis, D.L.1
Bradlow, H.L.2
Wolff, M.3
Woodruff, T.4
Hoel, D.G.5
Culver, H.A.6
-
7
-
-
0037255489
-
Oestrogenic activity of benzylparaben
-
Darbre P.D., Byford J.R., Shaw L.E., Hall S., Coldham N.G., Pope G.S., and Sauer M.J. Oestrogenic activity of benzylparaben. J. Appl. Toxicol. 23 (2003) 43-51
-
(2003)
J. Appl. Toxicol.
, vol.23
, pp. 43-51
-
-
Darbre, P.D.1
Byford, J.R.2
Shaw, L.E.3
Hall, S.4
Coldham, N.G.5
Pope, G.S.6
Sauer, M.J.7
-
8
-
-
0036182227
-
Oestrogenic activity of parabens in MCF7 human breast cancer cells
-
Byford J.R., Shaw L.E., Drew M.G.B., Pope G.S., Sauer M.J., and Darbre P.D. Oestrogenic activity of parabens in MCF7 human breast cancer cells. J. Steroid Biochem. Mol. Biol. 80 (2002) 49-60
-
(2002)
J. Steroid Biochem. Mol. Biol.
, vol.80
, pp. 49-60
-
-
Byford, J.R.1
Shaw, L.E.2
Drew, M.G.B.3
Pope, G.S.4
Sauer, M.J.5
Darbre, P.D.6
-
9
-
-
0842322823
-
Concentrations of parabens in human breast tumours
-
Darbre P.D., Aljarrah A., Miller W.R., Coldham N.G., Sauer M.J., and Pope G.S. Concentrations of parabens in human breast tumours. J. Appl. Toxicol. 24 (2004) 5-13
-
(2004)
J. Appl. Toxicol.
, vol.24
, pp. 5-13
-
-
Darbre, P.D.1
Aljarrah, A.2
Miller, W.R.3
Coldham, N.G.4
Sauer, M.J.5
Pope, G.S.6
-
10
-
-
0035085038
-
Structure-activity relationships for a large diverse set of natural, synthetic, and environmental estrogens
-
Fang H., Tong W., Shi L.M., Blair R., Perkins R., Branham W., Hass B.S., Xie Q., Dial S.L., Moland C.L., and Sheehan D.M. Structure-activity relationships for a large diverse set of natural, synthetic, and environmental estrogens. Chem. Res. Toxicol. 14 (2001) 280-294
-
(2001)
Chem. Res. Toxicol.
, vol.14
, pp. 280-294
-
-
Fang, H.1
Tong, W.2
Shi, L.M.3
Blair, R.4
Perkins, R.5
Branham, W.6
Hass, B.S.7
Xie, Q.8
Dial, S.L.9
Moland, C.L.10
Sheehan, D.M.11
-
11
-
-
0036156262
-
Prediction of estrogen receptor binding for 58,000 chemicals using an integrated system of a tree-based model with structural alerts
-
Hong H., Tong W., Fang H., Shi L., Xie Q., Perkins R., Walker J.D., Branham W., and Sheehan D.M. Prediction of estrogen receptor binding for 58,000 chemicals using an integrated system of a tree-based model with structural alerts. Environ. Health Perspect. 110 (2002) 29-36
-
(2002)
Environ. Health Perspect.
, vol.110
, pp. 29-36
-
-
Hong, H.1
Tong, W.2
Fang, H.3
Shi, L.4
Xie, Q.5
Perkins, R.6
Walker, J.D.7
Branham, W.8
Sheehan, D.M.9
-
12
-
-
0034020453
-
The estrogen receptor relative binding affinities of 188 natural and xenochemicals: Structure diversity of ligands
-
Blair R.M., Fang H., Branham W.S., Hass B.S., Dial S.L., Moland C.L., Tong W., Shi L., Perkings R., and Sheehan D.M. The estrogen receptor relative binding affinities of 188 natural and xenochemicals: Structure diversity of ligands. Toxicol. Sci. 54 (2000) 138-153
-
(2000)
Toxicol. Sci.
, vol.54
, pp. 138-153
-
-
Blair, R.M.1
Fang, H.2
Branham, W.S.3
Hass, B.S.4
Dial, S.L.5
Moland, C.L.6
Tong, W.7
Shi, L.8
Perkings, R.9
Sheehan, D.M.10
-
13
-
-
0031059270
-
The estradiol pharmacophore: Ligand structure-estrogen receptor binding affinity relationships and a model for the receptor binding site
-
Anstead G.M., Carlson K.E., and Katzenellenbogen J.A. The estradiol pharmacophore: Ligand structure-estrogen receptor binding affinity relationships and a model for the receptor binding site. Steroids 62 (1997) 268-303
-
(1997)
Steroids
, vol.62
, pp. 268-303
-
-
Anstead, G.M.1
Carlson, K.E.2
Katzenellenbogen, J.A.3
-
14
-
-
0000180135
-
Natural and anthropogenic environmental oestrogens: The scientific basis for risk assessment. Structure/activity relationships
-
Dodge J.A. Natural and anthropogenic environmental oestrogens: The scientific basis for risk assessment. Structure/activity relationships. Pure Appl. Chem. 70 (1998) 1725-1733
-
(1998)
Pure Appl. Chem.
, vol.70
, pp. 1725-1733
-
-
Dodge, J.A.1
-
15
-
-
0030667676
-
Molecular basis of agonism and antagonism in the oestrogen receptor
-
Brzozowski A.M., Pike A.C., Dauter Z., Hubbard R.E., Bonn T., Engstrom O., Ohman L., Greene G.L., Gustafsson J.A., and Carlquist M. Molecular basis of agonism and antagonism in the oestrogen receptor. Nature 389 (1997) 753-758
-
(1997)
Nature
, vol.389
, pp. 753-758
-
-
Brzozowski, A.M.1
Pike, A.C.2
Dauter, Z.3
Hubbard, R.E.4
Bonn, T.5
Engstrom, O.6
Ohman, L.7
Greene, G.L.8
Gustafsson, J.A.9
Carlquist, M.10
-
16
-
-
48849095056
-
-
http://www.rcsb.org/pdb
-
http://www.rcsb.org/pdb
-
-
-
-
17
-
-
48849088196
-
-
http://www.expasy.org/spdbv/
-
http://www.expasy.org/spdbv/
-
-
-
-
18
-
-
0142236572
-
Low mode search. An efficient, automated computational method for conformational analysis: Application to cyclic and acyclic alkanes and cyclic peptides
-
Kolossvary I., and Guida W.C. Low mode search. An efficient, automated computational method for conformational analysis: Application to cyclic and acyclic alkanes and cyclic peptides. J. Am. Chem. Soc. 118 (1996) 5011-5019
-
(1996)
J. Am. Chem. Soc.
, vol.118
, pp. 5011-5019
-
-
Kolossvary, I.1
Guida, W.C.2
-
19
-
-
0043162336
-
An internal-coordinate Monte Carlo method for searching conformational space
-
Chang G., Guida W.C., and Still W.C. An internal-coordinate Monte Carlo method for searching conformational space. J. Am. Chem. Soc. 111 (1989) 4379-4386
-
(1989)
J. Am. Chem. Soc.
, vol.111
, pp. 4379-4386
-
-
Chang, G.1
Guida, W.C.2
Still, W.C.3
-
20
-
-
0007793280
-
Conformations of cycloheptadecane. A comparison of methods for conformational searching
-
Saunders M., Houk K.N., Wu Y.D., Still W.C., Lipton M., Chang G., and Guida W.C. Conformations of cycloheptadecane. A comparison of methods for conformational searching. J. Am. Chem. Soc. 112 (1990) 1419-1427
-
(1990)
J. Am. Chem. Soc.
, vol.112
, pp. 1419-1427
-
-
Saunders, M.1
Houk, K.N.2
Wu, Y.D.3
Still, W.C.4
Lipton, M.5
Chang, G.6
Guida, W.C.7
-
21
-
-
0029912748
-
Development and testing of the OPLA-All Atom Force Field on conformational energetics and properties of organic liquids
-
Jorgensen W.L., Maxwell D.S., and Tirado-Rives J. Development and testing of the OPLA-All Atom Force Field on conformational energetics and properties of organic liquids. J. Am. Chem. Soc. 118 (1996) 11225-11236
-
(1996)
J. Am. Chem. Soc.
, vol.118
, pp. 11225-11236
-
-
Jorgensen, W.L.1
Maxwell, D.S.2
Tirado-Rives, J.3
-
22
-
-
48849111190
-
-
MacroModel version 7.0, Schrödinger, LLC, New York, NY, 1999.
-
MacroModel version 7.0, Schrödinger, LLC, New York, NY, 1999.
-
-
-
-
23
-
-
27344448074
-
Ab initio effective core potentials for molecular calculations. Potentials for K to Au including the outermost core orbitals
-
Hay P.J., and Wadt W.R. Ab initio effective core potentials for molecular calculations. Potentials for K to Au including the outermost core orbitals. J. Chem. Phys. 82 (1985) 299-310
-
(1985)
J. Chem. Phys.
, vol.82
, pp. 299-310
-
-
Hay, P.J.1
Wadt, W.R.2
-
24
-
-
77249127120
-
Benchmark databases for nonbonded interactions and their use to test Density Functional Theory
-
Zhao Y., and Truhlar D.G. Benchmark databases for nonbonded interactions and their use to test Density Functional Theory. J. Chem. Theory Comput. 1 (2005) 415-432
-
(2005)
J. Chem. Theory Comput.
, vol.1
, pp. 415-432
-
-
Zhao, Y.1
Truhlar, D.G.2
-
25
-
-
0000659222
-
Defining the domain of density functionals: charge-transfer complexes
-
Ruiz E., Salahub D.R., and Vela A. Defining the domain of density functionals: charge-transfer complexes. J. Am. Chem. Soc. 117 (1995) 1141-1142
-
(1995)
J. Am. Chem. Soc.
, vol.117
, pp. 1141-1142
-
-
Ruiz, E.1
Salahub, D.R.2
Vela, A.3
-
27
-
-
33746614482
-
Gaussian basis sets for use in correlated molecular calculations. I. The atoms boron through neon and hydrogen
-
Dunning Jr. T.H. Gaussian basis sets for use in correlated molecular calculations. I. The atoms boron through neon and hydrogen. J. Chem. Phys. 90 (1989) 1007-1023
-
(1989)
J. Chem. Phys.
, vol.90
, pp. 1007-1023
-
-
Dunning Jr., T.H.1
-
28
-
-
26444474547
-
Gaussian basis sets for use in correlated molecular calculations. IV. Calculation of static electrical response properties
-
Woon D.E., and Dunning Jr. T.H. Gaussian basis sets for use in correlated molecular calculations. IV. Calculation of static electrical response properties. J. Chem. Phys. 100 (1994) 2975-2988
-
(1994)
J. Chem. Phys.
, vol.100
, pp. 2975-2988
-
-
Woon, D.E.1
Dunning Jr., T.H.2
-
29
-
-
48849086583
-
-
Jaguar version 5.5, Schrödinger, LLC, New York, NY, 2005.
-
Jaguar version 5.5, Schrödinger, LLC, New York, NY, 2005.
-
-
-
-
30
-
-
0011164114
-
Noncovalent interactions: A challenge for experiment and theory
-
Muller-Dethlefs K., and Hobza P. Noncovalent interactions: A challenge for experiment and theory. Chem. Rev. 100 (2000) 143-168
-
(2000)
Chem. Rev.
, vol.100
, pp. 143-168
-
-
Muller-Dethlefs, K.1
Hobza, P.2
|