Calculation of Octanol/Water Partition Coefficients (logP) using Artificial Neural Networks and Connection Matrices
- 1 January 1997
- journal article
- research article
- Published by Wiley in Quantitative Structure-Activity Relationships
- Vol. 16 (3) , 224-230
- https://doi.org/10.1002/qsar.19970160306
Abstract
No abstract availableKeywords
This publication has 15 references indexed in Scilit:
- Calculation Procedures for Molecular Lipophilicity: a Comparative StudyQuantitative Structure-Activity Relationships, 1996
- ChemNet: A Novel Neural Network Based Method for Graph/Property MappingJournal of Chemical Information and Computer Sciences, 1995
- Neural Network-Graph Theory Approach to the Prediction of the Physical Properties of Organic CompoundsJournal of Chemical Information and Computer Sciences, 1994
- Statistics using neural networks: chance effectsJournal of Medicinal Chemistry, 1993
- Application of neural networks: quantitative structure-activity relationships of the derivatives of 2,4-diamino-5-(substituted-benzyl)pyrimidines as DHFR inhibitorsJournal of Medicinal Chemistry, 1992
- An application of neural networks in chemistry. Prediction of13C NMR chemical shiftsJournal of Mathematical Chemistry, 1991
- Applications of neural networks in quantitative structure-activity relationships of dihydrofolate reductase inhibitorsJournal of Medicinal Chemistry, 1991
- Applications for neural networks in chemistry. 2. A general connectivity representation for the prediction of regiochemistryTetrahedron Computer Methodology, 1990
- The Measurement of Partition CoefficientsQuantitative Structure-Activity Relationships, 1988
- The Generation of a Unique Machine Description for Chemical Structures-A Technique Developed at Chemical Abstracts Service.Journal of Chemical Documentation, 1965