-
1
-
-
0027298171
-
Quantitative sequence-activity models (QSAM) - Tools for sequence design
-
Jonsson, J., Norberg, T., Carlsson, L. et al., Quantitative sequence-activity models (QSAM) - tools for sequence design, Nucleic Acids Res., 1993, 20: 733-739.
-
(1993)
Nucleic Acids Res.
, vol.20
, pp. 733-739
-
-
Jonsson, J.1
Norberg, T.2
Carlsson, L.3
-
2
-
-
0013965569
-
Relations between chemical structure and biological activity in peptides
-
Sneath, P. H., Relations between chemical structure and biological activity in peptides, J. Theor. Biol., 1966, 12: 157-195.
-
(1966)
J. Theor. Biol.
, vol.12
, pp. 157-195
-
-
Sneath, P.H.1
-
3
-
-
0021931978
-
A statistical analysis of the physical properties of the 20 naturally occuring amino acids
-
Kidera, A., Konishi, Y., Oka, M. et al., A statistical analysis of the physical properties of the 20 naturally occuring amino acids, J. Protein Chem, 1985, 4: 23-55.
-
(1985)
J. Protein Chem
, vol.4
, pp. 23-55
-
-
Kidera, A.1
Konishi, Y.2
Oka, M.3
-
4
-
-
0022636036
-
The prediction of Bradykinin Potentiating Pentapeptide potency of pentapeptides. An example of a peptide quantitative structure-activity relationship
-
Hellberg, S., Sjostrom, M., Wold, S., The prediction of Bradykinin Potentiating Pentapeptide potency of pentapeptides. An example of a peptide quantitative structure-activity relationship, Acta Chem. Scand, 1986, 40: 135-140.
-
(1986)
Acta Chem. Scand
, vol.40
, pp. 135-140
-
-
Hellberg, S.1
Sjostrom, M.2
Wold, S.3
-
5
-
-
0023192524
-
Peptide quantitative structure-activity relationships, a multivariate approach
-
Hellberg, S., Sjostrom, M., Skagerberg, B. et al., Peptide quantitative structure-activity relationships, a multivariate approach, J. Med. Chem., 1987, 30: 1126-1135.
-
(1987)
J. Med. Chem.
, vol.30
, pp. 1126-1135
-
-
Hellberg, S.1
Sjostrom, M.2
Skagerberg, B.3
-
6
-
-
0023232669
-
Principal property values for six non-coded amino acids and their application to a structure-activity relationship for oxytocin peptide analogues
-
Wold, S., Eriksson, L., Hellberg, S. et al., Principal property values for six non-coded amino acids and their application to a structure-activity relationship for oxytocin peptide analogues, Can. J. Chem., 1987, 65: 1814-1820.
-
(1987)
Can. J. Chem.
, vol.65
, pp. 1814-1820
-
-
Wold, S.1
Eriksson, L.2
Hellberg, S.3
-
7
-
-
0025811052
-
Minimum analogue peptide sets (MAPS) for quantitative structure-activity relationships
-
Hellberg, S., Eriksson, L., Jonsson, J. et al., Minimum analogue peptide sets (MAPS) for quantitative structure-activity relationships, Int. J. Pept. Protein Res, 1991, 37: 414-424.
-
(1991)
Int. J. Pept. Protein Res
, vol.37
, pp. 414-424
-
-
Hellberg, S.1
Eriksson, L.2
Jonsson, J.3
-
8
-
-
0024425633
-
Multivariate parameterization of 55 coded and non-coded amino acids
-
Jonsson, J., Eriksson, L., Hellberg, S. et al., Multivariate parameterization of 55 coded and non-coded amino acids, Quant. Strut. Act. Relat, 1989, 8: 204-209.
-
(1989)
Quant. Strut. Act. Relat
, vol.8
, pp. 204-209
-
-
Jonsson, J.1
Eriksson, L.2
Hellberg, S.3
-
9
-
-
0032474777
-
New chemical descriptors for the design of biologically active peptides. A multivariatc charaterrization of 87 amino acids
-
Sandberg, M., Eriksson, L., Jonsson, J. et al., New chemical descriptors for the design of biologically active peptides. A multivariatc charaterrization of 87 amino acids, J. Med. Chem., 1998, 41: 2481-2491.
-
(1998)
J. Med. Chem.
, vol.41
, pp. 2481-2491
-
-
Sandberg, M.1
Eriksson, L.2
Jonsson, J.3
-
10
-
-
0029031962
-
Amino acid side chain descriptors for quantitative structure-activity relationship studies of peptide analogues
-
Collantes, E. R., Dunn, W. J., Amino acid side chain descriptors for quantitative structure-activity relationship studies of peptide analogues, J. Med. Chem., 1995, 38: 2705-2713.
-
(1995)
J. Med. Chem.
, vol.38
, pp. 2705-2713
-
-
Collantes, E.R.1
Dunn, W.J.2
-
11
-
-
4444340522
-
A novel MHDV descriptor for dipeptide QSAR studies
-
Liu, S. S., Cai, S. X., Li, Z. et al., A novel MHDV descriptor for dipeptide QSAR studies, J. Chin. Chem. Soc, 2001, 48: 253-260.
-
(2001)
J. Chin. Chem. Soc
, vol.48
, pp. 253-260
-
-
Liu, S.S.1
Cai, S.X.2
Li, Z.3
-
12
-
-
0000610485
-
MS-WHIM scores for amino acids: A new 3D-description for peptide QSAR and QSPR studies
-
Zaliani, A., Gancia, E., MS-WHIM scores for amino acids: A new 3D-description for peptide QSAR and QSPR studies, J. Chem. Inf. Comput. Sci., 1999, 39: 525-533.
-
(1999)
J. Chem. Inf. Comput. Sci.
, vol.39
, pp. 525-533
-
-
Zaliani, A.1
Gancia, E.2
-
13
-
-
0033087210
-
Topological shape and size of peptides: Identification of potential allele specific helper T cell antigenic sites
-
Raychaudhury, C., Banerjee, A., Bag, P. et al., Topological shape and size of peptides: Identification of potential allele specific helper T cell antigenic sites, J. Chem. Inf. Comput. Sci., 1999, 39: 248-254.
-
(1999)
J. Chem. Inf. Comput. Sci.
, vol.39
, pp. 248-254
-
-
Raychaudhury, C.1
Banerjee, A.2
Bag, P.3
-
14
-
-
10044249049
-
Quantitative structure-activity relationship for cyclic imide derivatives of protoporphyrinogen oxidase inhibitors: A study of quantum chemical descriptors from density functional theory
-
Wan, J., Zhang, L., Yang, G. F. et al., Quantitative structure-activity relationship for cyclic imide derivatives of protoporphyrinogen oxidase inhibitors: A study of quantum chemical descriptors from density functional theory, J. Chem. Inf. Comput. Sci., 2004, 44: 2099-2105.
-
(2004)
J. Chem. Inf. Comput. Sci.
, vol.44
, pp. 2099-2105
-
-
Wan, J.1
Zhang, L.2
Yang, G.F.3
-
15
-
-
8344289100
-
Quantitative structure-activity relationships for phenyl triazolinones of protoporphyrinogen oxidase inhibitors: A density functional theory study
-
Wan, J., Zhang, L., Yang, G. F., Quantitative structure-activity relationships for phenyl triazolinones of protoporphyrinogen oxidase inhibitors: A density functional theory study, J. Comput. Chem., 2004, 25: 1827-1832.
-
(2004)
J. Comput. Chem.
, vol.25
, pp. 1827-1832
-
-
Wan, J.1
Zhang, L.2
Yang, G.F.3
-
16
-
-
11744325593
-
Approach to estimation and prediction for normal boiling point (NBP) of alkanes based on a novel molecular distance edge (MDE) vector λ
-
Liu, S. S., Cai, C. X., Li, Z., Approach to estimation and prediction for normal boiling point (NBP) of alkanes based on a novel molecular distance edge (MDE) vector λ, J. Chem. Inf. Comput. Sci., 1998, 38: 387-394.
-
(1998)
J. Chem. Inf. Comput. Sci.
, vol.38
, pp. 387-394
-
-
Liu, S.S.1
Cai, C.X.2
Li, Z.3
-
17
-
-
0000970724
-
Molecular electronega tive-distancc vector (MEDV) relating to 15 properties of alkanes
-
Liu, S. S., Cai, S. X., Li, Z. et al., Molecular electronega tive-distancc vector (MEDV) relating to 15 properties of alkanes, J. Chem. Inf. Coraput. Sci., 2000, 40: 1337-1348.
-
(2000)
J. Chem. Inf. Coraput. Sci.
, vol.40
, pp. 1337-1348
-
-
Liu, S.S.1
Cai, S.X.2
Li, Z.3
-
18
-
-
0035263421
-
QSAR study of steroid benchmark and dipeptides based on MEDV-13
-
Liu, S. S., Yin, C. S., Li, Z. et al., QSAR study of steroid benchmark and dipeptides based on MEDV-13, J. Chem. Inf. Comput. Sci., 2001, 41: 321-329.
-
(2001)
J. Chem. Inf. Comput. Sci.
, vol.41
, pp. 321-329
-
-
Liu, S.S.1
Yin, C.S.2
Li, Z.3
-
19
-
-
0023751431
-
Comparative molecular field analysis (CoMFA). 1. Effect of shape on binding of steroids to carrier proteins
-
Cramer, R. D., Patterson, D. E., Bunce, J. D., Comparative molecular field analysis (CoMFA). 1. Effect of shape on binding of steroids to carrier proteins, J. Am. Chem. Soc., 1988, 110: 5959-5967.
-
(1988)
J. Am. Chem. Soc.
, vol.110
, pp. 5959-5967
-
-
Cramer, R.D.1
Patterson, D.E.2
Bunce, J.D.3
-
20
-
-
0021871375
-
A computational procedure for determining energetically favorable binding sites on biologically important molecules
-
Goodford, P. J., A computational procedure for determining energetically favorable binding sites on biologically important molecules, J. Med. Chem., 1985, 28: 849-857.
-
(1985)
J. Med. Chem.
, vol.28
, pp. 849-857
-
-
Goodford, P.J.1
-
21
-
-
0001681052
-
The collinearity problem in linear regression - The partial least squares (PLS) approach to generalized inverses
-
Wold, S., Ruhe, A., Wold, H. et al., The collinearity problem in linear regression - the partial least squares (PLS) approach to generalized inverses, Siam J. Sci. Statist. Comput., 1984, 5: 735-743.
-
(1984)
Siam J. Sci. Statist. Comput.
, vol.5
, pp. 735-743
-
-
Wold, S.1
Ruhe, A.2
Wold, H.3
-
22
-
-
0000626101
-
Link between orthogonal and standard multiple linear regression models
-
Šoškić, M., Link between orthogonal and standard multiple linear regression models, J. Chem. Inf. Comput. Sci., 1996, 36: 829-832
-
(1996)
J. Chem. Inf. Comput. Sci.
, vol.36
, pp. 829-832
-
-
Šoškić, M.1
-
23
-
-
0028467707
-
Application of genetic function approximation to Quantitative-structure Activity Relationships and Quantitative Structure-Property Relationships
-
Rogers, D., Hopfinger, A. J., Application of genetic function approximation to Quantitative-Structure Activity Relationships and Quantitative Structure-Property Relationships, J. Chem. Inf. Comput. Sci., 1994, 34: 854-866.
-
(1994)
J. Chem. Inf. Comput. Sci.
, vol.34
, pp. 854-866
-
-
Rogers, D.1
Hopfinger, A.J.2
-
24
-
-
0029230341
-
Automated descriptor selection for Quantitative Structure-activity Relationships using generalized simulated annealing
-
Sutter, J. M., Dixon, S. L., Jurs, P. C., Automated descriptor selection for Quantitative Structure-Activity Relationships using generalized simulated annealing, J. Chem. Inf. Comput. Sci., 1995, 35: 77-84.
-
(1995)
J. Chem. Inf. Comput. Sci.
, vol.35
, pp. 77-84
-
-
Sutter, J.M.1
Dixon, S.L.2
Jurs, P.C.3
-
25
-
-
0027232379
-
Amino acids characterization by GRID and multivariate data analysis
-
Cocchi, M., Johansson, E., Amino acids characterization by GRID and multivariate data analysis, Quant. Struct. Act. Relat, 1993, 12: 1-8.
-
(1993)
Quant. Struct. Act. Relat
, vol.12
, pp. 1-8
-
-
Cocchi, M.1
Johansson, E.2
-
26
-
-
4444234911
-
On structural parameterization and molecular modeling of peptide analogues by molecular electronegativity-edge vector (VMEE): Estimation and prediction for biological activity of pentapeptides
-
Li, S.Z., Fu, B. H., Wang, Y. Q. et al., On structural parameterization and molecular modeling of peptide analogues by molecular electronegativity-edge vector (VMEE): Estimation and prediction for biological activity of pentapeptides, J. Chin. Chem. Soc., 2001, 48: 937-944.
-
(2001)
J. Chin. Chem. Soc.
, vol.48
, pp. 937-944
-
-
Li, S.Z.1
Fu, B.H.2
Wang, Y.Q.3
-
27
-
-
0018240719
-
Structure-activity relationships of bradykinin potentiating pentapeptide peptides
-
Ufkes, J. G., Visser, R. J., Heuver, G. et al., Structure-activity relationships of bradykinin potentiating pentapeptide peptides, Eur. J. Pharmacol., 1978, 50: 119-122
-
(1978)
Eur. J. Pharmacol.
, vol.50
, pp. 119-122
-
-
Ufkes, J.G.1
Visser, R.J.2
Heuver, G.3
-
28
-
-
0020068060
-
Further studies on the structure-activity relationships of bradykinin potentiating pentapeptide peptides
-
Ufkes, J. G., Visser, R. J., Heuver, G. et al., Further studies on the structure-activity relationships of bradykinin potentiating pentapeptide peptides, Eur. J. Pharmacol., 1982, 79: 155-158.
-
(1982)
Eur. J. Pharmacol.
, vol.79
, pp. 155-158
-
-
Ufkes, J.G.1
Visser, R.J.2
Heuver, G.3
-
29
-
-
0042130018
-
Evaluation of the hydrophobic parameters of the amino acid side chains of peptides and their application in QSAR and conformational studies
-
Niwa, T. S., Ogino, A., Evaluation of the hydrophobic parameters of the amino acid side chains of peptides and their application in QSAR and conformational studies, Theochem., 1997, 392: 43-54.
-
(1997)
Theochem.
, vol.392
, pp. 43-54
-
-
Niwa, T.S.1
Ogino, A.2
-
30
-
-
0032012086
-
Rational combinatorial library design. 2. Rational design of targeted combinatorialn peptide libraries using chemical similarity probe and the inverse QSAR approaches
-
Sung, J., Wei, F., Tropsha, A., Rational combinatorial library design. 2. Rational design of targeted combinatorialn peptide libraries using chemical similarity probe and the inverse QSAR approaches, J. Chem. Inf. Comput. Sci., 1998, 38: 259-268.
-
(1998)
J. Chem. Inf. Comput. Sci.
, vol.38
, pp. 259-268
-
-
Sung, J.1
Wei, F.2
Tropsha, A.3
-
31
-
-
0345743662
-
Theoretical study on hydrophobicity of amino acids by the solvation free energy density model
-
Kim, J., Nam, K. Y., Cho, K. H. et al., Theoretical study on hydrophobicity of amino acids by the solvation free energy density model, Bull. Korean Chem. Soc., 2003, 24(12): 1742-1750.
-
(2003)
Bull. Korean Chem. Soc.
, vol.24
, Issue.12
, pp. 1742-1750
-
-
Kim, J.1
Nam, K.Y.2
Cho, K.H.3
-
32
-
-
0032563585
-
Preprocessing peptide sequences for multivariate sequence-property analysis
-
Andersson, P. M., Sjöstrom, M., Lundstedt, T., Preprocessing peptide sequences for multivariate sequence-property analysis, Chemom. Intell. Lab. Syst., 1998, 42: 41-50.
-
(1998)
Chemom. Intell. Lab. Syst.
, vol.42
, pp. 41-50
-
-
Andersson, P.M.1
Sjöstrom, M.2
Lundstedt, T.3
-
33
-
-
33144455184
-
A new set of amino acid descriptors and its application in peptide OSARs
-
Mei, H., Liao, Z., Zhou, Y. et al., A new set of amino acid descriptors and its application in peptide OSARs, Biopolym. Peptide Science, 2005, 80(6): 775-786.
-
(2005)
Biopolym. Peptide Science
, vol.80
, Issue.6
, pp. 775-786
-
-
Mei, H.1
Liao, Z.2
Zhou, Y.3
|