1. Title of Database: Pyrimidines
2. Sources:
Luis Torgo
http://www.ncc.up.pt/~ltorgo/Regression/DataSets.html
4. Relevant Information Paragraph:
The task consists of Learning Quantitative Structure Activity Relationships (QSARs).
The Inhibition of Dihydrofolate Reductase by Pyrimidines.The data are described in:
King, Ross .D., Muggleton, Steven., Lewis, Richard. and Sternberg, Michael.J.E. Drug
Design by machine learning: the use of inductive logic programming to model the
structure-activity relationships of trimethoprim analogues binding to dihydrofolate
reductase.
5. Number of Instances: 74
6. Number of Attributes: 27
7. Attribute information:
p1_polar : continuous
p1_size : continuous
p1_flex : continuous
p1_h_doner : continuous
p1_h_acceptor : continuous
p1_pi_doner : continuous
p1_pi_acceptor : continuous
p1_polarisable : continuous
p1_sigma : continuous
p2_polar : continuous
p2_size : continuous
p2_flex : continuous
p2_h_doner : continuous
p2_h_acceptor : continuous
p2_pi_doner : continuous
p2_pi_acceptor : continuous
p2_polarisable : continuous
p2_sigma : continuous
p3_polar : continuous
p3_size : continuous
p3_flex : continuous
p3_h_doner : continuous
p3_h_acceptor : continuous
p3_pi_doner : continuous
p3_pi_acceptor : continuous
p3_polarisable : continuous
p3_sigma : continuous
activity : continuous
8. Missing Attribute Values: None