-
2
-
-
0012777568
-
JATOON: Java tools for neural networks
-
Aires-de-Sousa J. JATOON: Java tools for neural networks. Chemom. Intell. Lab. Syst. 61 (2002) 167-173
-
(2002)
Chemom. Intell. Lab. Syst.
, vol.61
, pp. 167-173
-
-
Aires-de-Sousa, J.1
-
3
-
-
0000431584
-
QSPR analysis of HPLC column capacity factors for a set of high-energy materials using electronic van der Waals surface property descriptors computed by transferable atom equivalent method
-
Breneman C.M., and Rehm M. QSPR analysis of HPLC column capacity factors for a set of high-energy materials using electronic van der Waals surface property descriptors computed by transferable atom equivalent method. J. Comput. Chem. 18 (1997) 182-197
-
(1997)
J. Comput. Chem.
, vol.18
, pp. 182-197
-
-
Breneman, C.M.1
Rehm, M.2
-
4
-
-
0038468542
-
Impact of the replacement heuristic in a grouping genetic algorithm
-
Brown E.C., and Sumichrast R.T. Impact of the replacement heuristic in a grouping genetic algorithm. Computers Oper. Res. 30 (2003) 1575-1593
-
(2003)
Computers Oper. Res.
, vol.30
, pp. 1575-1593
-
-
Brown, E.C.1
Sumichrast, R.T.2
-
5
-
-
0036628553
-
Structure-based classification of antibacterial activity
-
Cronin M.T.D., Aptula A.O., Dearden J.C., Duffy J.C., Netzeva T.I., Patel H., Rowe P.H., Schultz T.W., Worth A.P., Voutzoulidis K., and Schuurmann G. Structure-based classification of antibacterial activity. J. Chem. Inf. Comput. Sci. 42 (2002) 869-878
-
(2002)
J. Chem. Inf. Comput. Sci.
, vol.42
, pp. 869-878
-
-
Cronin, M.T.D.1
Aptula, A.O.2
Dearden, J.C.3
Duffy, J.C.4
Netzeva, T.I.5
Patel, H.6
Rowe, P.H.7
Schultz, T.W.8
Worth, A.P.9
Voutzoulidis, K.10
Schuurmann, G.11
-
6
-
-
0021518209
-
Stochastic relaxation, Gibbs distributions and Bayesian restoration of images
-
Geman S., and Geman D. Stochastic relaxation, Gibbs distributions and Bayesian restoration of images. IEEE Trans. Pattern Anal. Mach. Intell. 6 (1984) 721-741
-
(1984)
IEEE Trans. Pattern Anal. Mach. Intell.
, vol.6
, pp. 721-741
-
-
Geman, S.1
Geman, D.2
-
7
-
-
0003722376
-
-
Addison-Wesley, Berkeley, CA
-
Goldberg D.E. Genetic Algorithms in Search, Optimization, and Machine Learning (1989), Addison-Wesley, Berkeley, CA
-
(1989)
Genetic Algorithms in Search, Optimization, and Machine Learning
-
-
Goldberg, D.E.1
-
8
-
-
0342484444
-
Evaluation of crossover techniques in genetic algorithm based optimum structural design
-
Hasancebi O., and Erbatur F. Evaluation of crossover techniques in genetic algorithm based optimum structural design. Computers Struct. 78 (2000) 435-448
-
(2000)
Computers Struct.
, vol.78
, pp. 435-448
-
-
Hasancebi, O.1
Erbatur, F.2
-
9
-
-
0004013878
-
-
Doctoral dissertation, University of Michigan, Dissertation Abstracts International, University Microfilms No. 71-23
-
Hollstein, R.B., 1971. Artificial genetic adaptation in computer control systems. Doctoral dissertation, University of Michigan, Dissertation Abstracts International, 32, 1510B (University Microfilms No. 71-23,773).
-
(1971)
Artificial genetic adaptation in computer control systems
, vol.32
-
-
Hollstein, R.B.1
-
10
-
-
0035227873
-
A novel method for building regression tree models for QSAR based on artificial ant colony systems
-
Izrailev S., and Agrafiotis D. A novel method for building regression tree models for QSAR based on artificial ant colony systems. J. Chem. Inf. Comput. Sci. 41 (2001) 176-180
-
(2001)
J. Chem. Inf. Comput. Sci.
, vol.41
, pp. 176-180
-
-
Izrailev, S.1
Agrafiotis, D.2
-
11
-
-
0036581948
-
Variable selection for QSAR by artificial ant colony systems
-
Izrailev S., and Agrafiotis D. Variable selection for QSAR by artificial ant colony systems. SAR QSAR Environ. Res. 3-4 (2002) 417-423
-
(2002)
SAR QSAR Environ. Res.
, vol.3-4
, pp. 417-423
-
-
Izrailev, S.1
Agrafiotis, D.2
-
12
-
-
0000353230
-
The characterization of chemical structures using molecular properties. A Survey
-
Livingstone D.J. The characterization of chemical structures using molecular properties. A Survey. J. Chem. Inf. Comput. Sci. 40 (2000) 195-209
-
(2000)
J. Chem. Inf. Comput. Sci.
, vol.40
, pp. 195-209
-
-
Livingstone, D.J.1
-
13
-
-
0002483594
-
Multivariate regression outperforms several robust architectures of neural networks in QSAR modeling
-
Lucic B., and Trinajstic N. Multivariate regression outperforms several robust architectures of neural networks in QSAR modeling. J. Chem. Inf. Comput. Sci. 39 (1999) 121-132
-
(1999)
J. Chem. Inf. Comput. Sci.
, vol.39
, pp. 121-132
-
-
Lucic, B.1
Trinajstic, N.2
-
14
-
-
0033538864
-
Comparison of three different QSAR/QSPR generation techniques
-
Luke B.T. Comparison of three different QSAR/QSPR generation techniques. J. Mol. Struct. (Theochem) 468 (1999) 13-20
-
(1999)
J. Mol. Struct. (Theochem)
, vol.468
, pp. 13-20
-
-
Luke, B.T.1
-
15
-
-
0034710284
-
Comparison of different data set screening methods for use in QSAR/QSPR generation studies
-
Luke B.T. Comparison of different data set screening methods for use in QSAR/QSPR generation studies. J. Mol. Struct. (Theochem) 507 (2000) 229-238
-
(2000)
J. Mol. Struct. (Theochem)
, vol.507
, pp. 229-238
-
-
Luke, B.T.1
-
16
-
-
0037317266
-
Fuzzy structure-activity relationships
-
Luke B.T. Fuzzy structure-activity relationships. SAR QSAR Environ. Res. 14 (2003) 41-57
-
(2003)
SAR QSAR Environ. Res.
, vol.14
, pp. 41-57
-
-
Luke, B.T.1
-
17
-
-
0007124195
-
-
Office of Technology Licensing, Stanford University
-
Parker D.B. Learning Logic, Invention Report, S81-64, File 1 (1982), Office of Technology Licensing, Stanford University
-
(1982)
Learning Logic, Invention Report, S81-64, File 1
-
-
Parker, D.B.1
-
18
-
-
0028467707
-
Application of genetic function approximation to quantitative structure-activity relationships and quantitative structure-property relationships
-
Rogers D., and Hopfinger A.J. Application of genetic function approximation to quantitative structure-activity relationships and quantitative structure-property relationships. J. Chem. Inf. Comput. Sci. 34 (1994) 854-866
-
(1994)
J. Chem. Inf. Comput. Sci.
, vol.34
, pp. 854-866
-
-
Rogers, D.1
Hopfinger, A.J.2
-
19
-
-
0003444646
-
-
MIT Press, Cambridge, MA pp. 318-362
-
Rumelhart D.E., Hilton G.E., and Williams R.J. Learning internal representations by error propagation. parallel distributed processing vol. 1 (1986), MIT Press, Cambridge, MA pp. 318-362
-
(1986)
parallel distributed processing
, vol.1
-
-
Rumelhart, D.E.1
Hilton, G.E.2
Williams, R.J.3
-
20
-
-
0000383868
-
Parallel networks that learn to pronounce English text
-
Sejnowski T.J., and Rosenberg C.R. Parallel networks that learn to pronounce English text. Complex Syst. 1 (1987) 145-168
-
(1987)
Complex Syst.
, vol.1
, pp. 145-168
-
-
Sejnowski, T.J.1
Rosenberg, C.R.2
-
21
-
-
0037142302
-
Quantitative structure-activity relationship analysis of functionalized amino acid anticonvulsant agents using k nearest neighbor and simulated annealing PLS methods
-
Shen M., LeTiran A., Xiao Y., Golbraikh A., Kohn H., and Tropsha A. Quantitative structure-activity relationship analysis of functionalized amino acid anticonvulsant agents using k nearest neighbor and simulated annealing PLS methods. J. Med. Chem. 45 (2002) 2811-2823
-
(2002)
J. Med. Chem.
, vol.45
, pp. 2811-2823
-
-
Shen, M.1
LeTiran, A.2
Xiao, Y.3
Golbraikh, A.4
Kohn, H.5
Tropsha, A.6
-
22
-
-
0029970338
-
Evolutionary optimization in quantitative structure-activity relationship: an application of genetic neural networks
-
So S., and Karplus M. Evolutionary optimization in quantitative structure-activity relationship: an application of genetic neural networks. J. Med. Chem. 39 (1996) 1521-1530
-
(1996)
J. Med. Chem.
, vol.39
, pp. 1521-1530
-
-
So, S.1
Karplus, M.2
-
23
-
-
45949121309
-
Fast simulated annealing
-
Szu H., and Hartley R. Fast simulated annealing. Phys. Lett. 1222 (1987) 157-162
-
(1987)
Phys. Lett.
, vol.1222
, pp. 157-162
-
-
Szu, H.1
Hartley, R.2
-
24
-
-
0036628554
-
Chemical information based scaling of molecular descriptors: a universal chemical scale for library design
-
Tounge B.A., Pfahler L.B., and Reynolds C.H. Chemical information based scaling of molecular descriptors: a universal chemical scale for library design. J. Chem. Inf. Comput. Sci. 42 (2002) 879-884
-
(2002)
J. Chem. Inf. Comput. Sci.
, vol.42
, pp. 879-884
-
-
Tounge, B.A.1
Pfahler, L.B.2
Reynolds, C.H.3
-
25
-
-
0035003411
-
Identification of the descriptor pharmacophores using variable selection QSAR: application to database mining
-
Tropsha A., and Zheng W. Identification of the descriptor pharmacophores using variable selection QSAR: application to database mining. Curr. Pharm. Des. 7 (2001) 599-612
-
(2001)
Curr. Pharm. Des.
, vol.7
, pp. 599-612
-
-
Tropsha, A.1
Zheng, W.2
-
29
-
-
0003389370
-
The GENITOR algorithm and selection pressure: why rank-based allocation of reproductive trials is best
-
Schaffer J.D. (Ed), Morgan Kaufmann, Los Altos, CA
-
Whitley D. The GENITOR algorithm and selection pressure: why rank-based allocation of reproductive trials is best. In: Schaffer J.D. (Ed). Proceedings of the Third International Conference on Genetic Algorithms (1989), Morgan Kaufmann, Los Altos, CA 116-121
-
(1989)
Proceedings of the Third International Conference on Genetic Algorithms
, pp. 116-121
-
-
Whitley, D.1
-
30
-
-
0028349692
-
Machine learning techniques to diagnose breast cancer from fine-needle aspirates
-
Wolberg W.H., Street W.N., and Mangasarian O.L. Machine learning techniques to diagnose breast cancer from fine-needle aspirates. Cancer Lett. 77 (1994) 163-171
-
(1994)
Cancer Lett.
, vol.77
, pp. 163-171
-
-
Wolberg, W.H.1
Street, W.N.2
Mangasarian, O.L.3
-
31
-
-
77956778351
-
-
The Santa Fe Institute, Santa Fe, NM, USA
-
Wolpert D.H., and Macready W.G. No Free Lunch Theorems for Search. Technical Report TR-92-02-010 (1995), The Santa Fe Institute, Santa Fe, NM, USA
-
(1995)
Technical Report TR-92-02-010
-
-
Wolpert, D.H.1
Macready, W.G.2
|