-
1
-
-
0002809440
-
-
Eds: W. J. Lyman, W. F. Reehl, D. H. Rosenblatt), McGraw Hill, New York
-
S. E. Bysshe, Bioconcentration Factor in Aquatic Organisms, in Handbook of Chemical Property Estimation Methods (Eds: W. J. Lyman, W. F. Reehl, D. H. Rosenblatt), McGraw Hill, New York 1982, pp. 5-30.
-
(1982)
Bioconcentration Factor in Aquatic Organisms, in Handbook of Chemical Property Estimation Methods
, pp. 5-30
-
-
Bysshe, S.E.1
-
4
-
-
0004445714
-
-
Ministry of Environment and Energy for Ontario, Ontario, Canada
-
Candidate Substances List for Bans or Phase-outs, Ministry of Environment and Energy for Ontario, Ontario, Canada 1992.
-
(1992)
Candidate Substances List for Bans or Phase-outs
-
-
-
5
-
-
70449827758
-
-
US Environmental Protection Agency, Washington, DC
-
Waste Minimization Prioritization Tool, Beta Test Version 1.0, User's Guide and System Documentation, EPA/530-R-97-019, Draft Report, US Environmental Protection Agency, Washington, DC 1997.
-
(1997)
Waste Minimization Prioritization Tool, Beta Test Version 1.0, User's Guide and System Documentation, EPA/530-R-97-019, Draft Report
-
-
-
9
-
-
73449143145
-
Comparative QSTR Study of Saturated Alcohols Based on Topological Constitutional, Geometrical, and Getawey Descriptors
-
in press, DOI: 10.1007/s00044-009-9166-z
-
A. K. R. Khan, V. K. Sahu, R. K. Singh, S. A. Khan, Comparative QSTR Study of Saturated Alcohols Based on Topological Constitutional, Geometrical, and Getawey Descriptors, Med. Chem. Res., in press. DOI: 10.1007/s00044-009-9166-z.
-
Med. Chem. Res.
-
-
Khan, A.K.R.1
Sahu, V.K.2
Singh, R.K.3
Khan, S.A.4
-
10
-
-
0028949465
-
QSAR in Toxicology. 1. Prediction of Aquatic Toxicity
-
M. T. D. Cronin, J. C. Dearden, QSAR in Toxicology. 1. Prediction of Aquatic Toxicity, Quant. Struct. Act. Relat. 1995, 14 (1), 1.
-
(1995)
Quant. Struct. Act. Relat
, vol.14
, Issue.1
, pp. 1
-
-
Cronin, M.T.D.1
Dearden, J.C.2
-
11
-
-
58149239653
-
Study of a Series of Alcohol Derivatives Against Tetrahymena pyriformis
-
R. K. Singh, A. K. R. Khan, V. K. Sahu, P. P. Singh, Comparative QSTR Study of a Series of Alcohol Derivatives Against Tetrahymena pyriformis, Int. J. Quantum Chem. 2009, 109 (2), 185.
-
(2009)
Int. J. Quantum Chem.
, vol.109
, Issue.2
, pp. 185
-
-
Singh, R.K.1
Khan, A.K.R.2
Sahu, V.K.3
Singh, P.P.4
Comparative, Q.S.T.R.5
-
12
-
-
33846804380
-
QSAR Study of Small Organic Molecules Against Tetrahymena pyriformis
-
F. A. Pasha, H. K. Srivastava, A. Srivastava, P. P. Singh, QSAR Study of Small Organic Molecules Against Tetrahymena pyriformis, QSAR Comb. Sci. 2007, 26, 69.
-
(2007)
QSAR Comb. Sci.
, vol.26
, pp. 69
-
-
Pasha, F.A.1
Srivastava, H.K.2
Srivastava, A.3
Singh, P.P.4
-
13
-
-
0037709858
-
QSAR Modeling of Bioconcentration Factor by Theoretical Molecular Descriptors
-
P. Gramatica, E. Papa, QSAR Modeling of Bioconcentration Factor by Theoretical Molecular Descriptors, QSAR Comb. Sci. 2003, 22 (3), 374.
-
(2003)
QSAR Comb. Sci.
, vol.22
, Issue.3
, pp. 374
-
-
Gramatica, P.1
Papa, E.2
-
14
-
-
0001728908
-
Quantum-chemical Descriptors in QSAR/ QSPR Studies
-
M. Karelson, V. S. Lobanov, Quantum-chemical Descriptors in QSAR/ QSPR Studies, J. Am. Chem. Soc. 1996, 96 (3), 1027.
-
(1996)
J. Am. Chem. Soc.
, vol.96
, Issue.3
, pp. 1027
-
-
Karelson, M.1
Lobanov, V.S.2
-
15
-
-
84988129057
-
Optimization of Parameters for Semiempirical Methods, I. Method
-
J. J. P. Stewart, Optimization of Parameters for Semiempirical Methods, I. Method, J. Comput. Chem. 1989, 10 (2), 209.
-
(1989)
J. Comput. Chem.
, vol.10
, Issue.2
, pp. 209
-
-
Stewart, J.J.P.1
-
16
-
-
0000313347
-
Ground States of Molecules. 45. MNDO Results for Molecules Containing Beryllium
-
M. J. S. Dewar, H. S. Rzepa, Ground States of Molecules. 45. MNDO Results for Molecules Containing Beryllium, J. Am. Chem. Soc. 1978, 100 (3),777.
-
(1978)
J. Am. Chem. Soc.
, vol.100
, Issue.3
, pp. 777
-
-
Dewar, M.J.S.1
Rzepa, H.S.2
-
17
-
-
23144463498
-
QSAR Study of Estrogen with the Help of PM3-based Descriptors
-
F. A. Pasha, H. K. Srivastava, P. P. Singh, QSAR Study of Estrogen with the Help of PM3-based Descriptors, Int. J. Quantum Chem. 2005, 104, 87.
-
(2005)
Int. J. Quantum Chem.
, vol.104
, pp. 87
-
-
Pasha, F.A.1
Srivastava, H.K.2
Singh, P.P.3
-
18
-
-
70449963145
-
Hydrophobic, Topological, and Steric Parameter Based QSAR Study on Peptidic HIV-protease Inhibitors
-
P. P. Singh, V. K. Sahu, P. Singh, R. K. Singh, Hydrophobic, Topological, and Steric Parameter Based QSAR Study on Peptidic HIV-protease Inhibitors, Org. Chem.: Ind. J. 2008, 4 (4), 284.
-
(2008)
Org. Chem.: Ind. J.
, vol.4
, Issue.4
, pp. 284
-
-
Singh, P.P.1
Sahu, V.K.2
Singh, P.3
Singh, R.K.4
-
19
-
-
77955536693
-
PM3 Based QSAR Study of b-Carbolines Using Electronegativity and Absolute Hardness as Reactive Parameters
-
P. P. Singh, A. K. Soni, V. K. Sahu, PM3 Based QSAR Study of b-Carbolines Using Electronegativity and Absolute Hardness as Reactive Parameters, Org. Chem.: Ind. J. 2009, 5 (1), 55.
-
(2009)
Org. Chem.: Ind. J
, vol.5
, Issue.1
, pp. 55
-
-
Singh, P.P.1
Soni, A.K.2
Sahu, V.K.3
-
20
-
-
67049155254
-
Drug-receptor Interation-based Quantitative Structure-Activity Relationship of Tetrahydroimidazodiazepinone
-
V. K. Sahu, A. K. R. Khan, R. K. Singh, P. P. Singh, Drug-receptor Interation-based Quantitative Structure-Activity Relationship of Tetrahydroimidazodiazepinone, Int. J. Quantum Chem. 2009, 109 (6), 1243.
-
(1243)
Int. J. Quantum Chem.
, vol.109
, Issue.6
, pp. 2009
-
-
Sahu, V.K.1
Khan, A.K.R.2
Singh, R.K.3
Singh, P.P.4
-
21
-
-
0001648985
-
Charge Transfer Complexes and Frontier Orbital Energies in QSAR: A Congeneric Series of Electron Acceptors
-
B. W. Clare, Charge Transfer Complexes and Frontier Orbital Energies in QSAR: A Congeneric Series of Electron Acceptors, J. Mol. Struct. 1995,337 (2),139.
-
(1995)
J. Mol. Struct.
, vol.337
, Issue.2
, pp. 139
-
-
Clare, B.W.1
-
22
-
-
70450063489
-
Stability Index Based Quantitative Structure-activity Relationship Study of b-Carbolines
-
in press
-
A. K. Soni, V. K. Sahu, P. P. Singh, Stability Index Based Quantitative Structure-activity Relationship Study of b-Carbolines, Asian J. Chem., in press.
-
Asian J. Chem.
-
-
Soni, A.K.1
Sahu, V.K.2
Singh, P.P.3
-
23
-
-
0342415826
-
Activation Hardness: New Index for Describing the Orientation of Electrophilic Aromatic Substitution
-
J. W. McIver Jr., A. Komornicki, Activation Hardness: New Index for Describing the Orientation of Electrophilic Aromatic Substitution, J. Am. Chem. Soc. 1972, 94 (8), 2625.
-
(2625)
J. Am. Chem. Soc.
, vol.94
, Issue.8
, pp. 1972
-
-
McIver Jr, J.W.1
Komornicki, A.2
-
24
-
-
0343626600
-
A New Electroaffinity Scale; Together with Data on Valence States and on Valence Ionization Potentials and Electron Affinities
-
R. S. Mulliken, A New Electroaffinity Scale; Together with Data on Valence States and on Valence Ionization Potentials and Electron Affinities, J. Chem. Phys. 1934, 2 (11), 782.
-
(1934)
J. Chem. Phys.
, vol.2
, Issue.11
, pp. 782
-
-
Mulliken, R.S.1
-
25
-
-
0004053611
-
-
3rd ed., John Wiley & Sons, New York
-
D. Voet, J. G. Voet, Biochemistry, 3rd ed., John Wiley & Sons, New York 2004, p. 531.
-
(2004)
Biochemistry
, pp. 531
-
-
Voet, D.1
Voet, J.G.2
-
26
-
-
0027423502
-
Interfacing Statistics, Quantum Chemistry, and Molecular Modeling
-
G. L. Olson et al., Interfacing Statistics, Quantum Chemistry, and Molecular Modeling, J. Med. Chem. 1993, 36 (21), 3039.
-
(1993)
J. Med. Chem.
, vol.36
, Issue.21
, pp. 3039
-
-
Olson, G.L.1
-
27
-
-
67749113767
-
Hydrophobic, Polar and Hydrogen Bonding Based Drug-receptor Interaction of Tetrahydroimidazobenzodiazepinones
-
V. K. Sahu, A. K. R. Khan, R. K. Singh, P. P. Singh, Hydrophobic, Polar and Hydrogen Bonding Based Drug-receptor Interaction of Tetrahydroimidazobenzodiazepinones, Am. J. Immunol. 2008, 4 (3), 33.
-
(2008)
Am. J. Immunol.
, vol.4
, Issue.3
, pp. 33
-
-
Sahu, V.K.1
Khan, A.K.R.2
Singh, R.K.3
Singh, P.P.4
|