-
1
-
-
23844480138
-
Graph kernels for chemical informatics
-
L. Ralaivola, S. J. Swamidass, H. Saigo, and P. Baldi, "Graph kernels for chemical informatics," Neural Networks, vol. 18, no. 8, pp. 1093-1110, 2005.
-
(2005)
Neural Networks
, vol.18
, Issue.8
, pp. 1093-1110
-
-
Ralaivola, L.1
Swamidass, S.J.2
Saigo, H.3
Baldi, P.4
-
2
-
-
70349610382
-
-
Ph.D. dissertation, Computer Science, Ludwig-Maximilians-University Munich
-
K. M. Borgwardt, "Graph kernels," Ph.D. dissertation, Computer Science, Ludwig-Maximilians-University Munich, 2007.
-
(2007)
Graph Kernels
-
-
Borgwardt, K.M.1
-
4
-
-
4444288656
-
Kernels and distances for structured data
-
T. Gärtner, J. W. Lloyd, and P. A. Flach, "Kernels and distances for structured data," Machine Learning, vol. 57, no. 3, pp. 205-232, 2004.
-
(2004)
Machine Learning
, vol.57
, Issue.3
, pp. 205-232
-
-
Gärtner, T.1
Lloyd, J.W.2
Flach, P.A.3
-
6
-
-
84864066856
-
Fast computation of graph kernels
-
B. Schölkopf, J. Platt, and T. Hoffman, Eds. Cambridge, MA: MIT Press
-
S. Vishwanathan, K. M. Borgwardt, and N. N. Schraudolph, "Fast computation of graph kernels," in Advances in Neural Information Processing Systems 19, B. Schölkopf, J. Platt, and T. Hoffman, Eds. Cambridge, MA: MIT Press, 2007, pp. 1449-1456.
-
(2007)
Advances in Neural Information Processing Systems
, vol.19
, pp. 1449-1456
-
-
Vishwanathan, S.1
Borgwardt, K.M.2
Schraudolph, N.N.3
-
8
-
-
0001330098
-
A general coefficient of similarity and some of its properties
-
[Online]. Available
-
J. C. Gower, "A general coefficient of similarity and some of its properties," Biometrics, vol. 27, no. 4, pp. 857-871, 1971. [Online]. Available: http://dx.doi.org/10.2307/2528823.
-
(1971)
Biometrics
, vol.27
, Issue.4
, pp. 857-871
-
-
Gower, J.C.1
-
12
-
-
0026087709
-
Structure-activity relationship of mutagenic aromatic and heteroaromatic nitro compounds. Correlation with molecular orbital energies and hydrophobicity
-
A. Debnath, R. Lopez de Compadre, G. Debnath, A. Shusterman, and C. Hansch, "Structure-activity relationship of mutagenic aromatic and heteroaromatic nitro compounds. correlation with molecular orbital energies and hydrophobicity." Journal of Medicinal Chemistry, vol. 34, pp. 786-797, 1991.
-
(1991)
Journal of Medicinal Chemistry
, vol.34
, pp. 786-797
-
-
Debnath, A.1
Lopez De Compadre, R.2
Debnath, G.3
Shusterman, A.4
Hansch, C.5
-
13
-
-
0038156116
-
A survey of the predictive toxicology challenge 2000-2001
-
C. Helma and S. Kramer, "A survey of the predictive toxicology challenge 2000-2001." Bioinformatics, vol. 19, no. 10, pp. 1179-1182, 2003.
-
(2003)
Bioinformatics
, vol.19
, Issue.10
, pp. 1179-1182
-
-
Helma, C.1
Kramer, S.2
-
15
-
-
0031552362
-
Development and validation of a genetic algorithm for flexible docking
-
G. Jones, P. Willett, R. C. Glen, A. R. Leach, and R. Taylor, "Development and validation of a genetic algorithm for flexible docking." Journal of Molcular Biology, vol. 267, no. 3, pp. 727-748, 1997.
-
(1997)
Journal of Molcular Biology
, vol.267
, Issue.3
, pp. 727-748
-
-
Jones, G.1
Willett, P.2
Glen, R.C.3
Leach, A.R.4
Taylor, R.5
-
16
-
-
0031191630
-
The use of the area under the ROC curve in the evaluation of machine learning algorithms
-
[Online]. Available
-
A. P. Bradley, "The use of the area under the ROC curve in the evaluation of machine learning algorithms," Pattern Recognition, vol. 30, no. 7, pp. 1145-1159, 1997. [Online]. Available: http://dx.doi.org/10.1016/ S0031-3203(96)00142-2.
-
(1997)
Pattern Recognition
, vol.30
, Issue.7
, pp. 1145-1159
-
-
Bradley, A.P.1
-
17
-
-
7544223741
-
A survey of outlier detection methodologies
-
V. Hodge and J. Austin, "A survey of outlier detection methodologies," Artificial Intelligence Review, vol. 22, no. 2, pp. 85-126, 2004.
-
(2004)
Artificial Intelligence Review
, vol.22
, Issue.2
, pp. 85-126
-
-
Hodge, V.1
Austin, J.2
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