http://rdf.ncbi.nlm.nih.gov/pubchem/patent/CN-105005641-B
Outgoing Links
| Predicate | Object |
|---|---|
| classificationIPCInventive | http://rdf.ncbi.nlm.nih.gov/pubchem/patentipc/G06K9-66 http://rdf.ncbi.nlm.nih.gov/pubchem/patentipc/G06F17-50 |
| filingDate | 2015-06-18-04:00^^<http://www.w3.org/2001/XMLSchema#date> |
| grantDate | 2018-01-16-04:00^^<http://www.w3.org/2001/XMLSchema#date> |
| publicationDate | 2018-01-16-04:00^^<http://www.w3.org/2001/XMLSchema#date> |
| publicationNumber | CN-105005641-B |
| titleOfInvention | Method of the QSAR model predictions organic compound based on comprehensive toxicity binding mode classification structure to Daphnia magna acute toxicity |
| abstract | The invention discloses a kind of organic compound based on comprehensive toxicity binding mode classification structure to Daphnia magna acute toxicity QSAR models.A comprehensive toxic action method for classifying modes is developed first, compound has been classified based on architectural feature using this method.After compound is classified according to this method, on the basis of molecular structure of compounds descriptor is obtained, by multiple linear regression analysis method, EC is constructed 50 Model, it can quickly and efficiently predict EC of the organic compound to Daphnia magna acute effect concentration 50 Value；And models fitting goodness, robustness and predictive ability are characterized on QSAR model constructions and checking directive/guide according to the Organization of Economy and Cooperation Development；Model application domain is clear and definite；Forecast model is concise, is easy to sequencing, can provide significant data for the acute toxicity evaluation of organic chemicals and support. |
| priorityDate | 2015-06-18-04:00^^<http://www.w3.org/2001/XMLSchema#date> |
| type | http://data.epo.org/linked-data/def/patent/Publication |
Incoming Links
Total number of triples: 39.