Correlation properties of the autocorrelation descriptor for molecules

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Volumn , Issue 45, 2002, Pages 27-33

  Hollas, Boris ^a  

^a UNIVERSITY OF ULM   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

ARTICLE; CORRELATION ANALYSIS; DATA BASE; INFORMATION; MOLECULE; PHYSICAL CHEMISTRY; QUANTITATIVE STRUCTURE ACTIVITY RELATION; SCREENING;

EID: 0036344151     PISSN: 03406253     EISSN: None     Source Type: Journal    
DOI: None     Document Type: Article

References (14)

1. Structural determination of parrafin boiling points
2. Autocorrelation of a topological structure: A new molecular descriptor
3. Estimating n-octanol/water partition coefficients from the autocorrelation method
4. Prediction of partition coefficients using autocorrelation descriptors
5. Comparison of reliability of log P values calculated from a group contribution approach and from the autocorrelation method
6. Autocorrelation of molecular properties for modelling corticosteroid binding globulin and cytosolic Ah receptor activity by neural networks
7. Locating biologically active compounds in medium-sized heterogeneous datasets by topological autocorrelation vectors: Dopamine and benzodiazepine agonists
8. Autocorrelation descriptors for modelling (eco)toxicological endpoints