http://rdf.ncbi.nlm.nih.gov/pubchem/patent/JP-2015040757-A
Outgoing Links
| Predicate | Object |
|---|---|
| assignee | http://rdf.ncbi.nlm.nih.gov/pubchem/patentassignee/MD5_82cbc291d77c061ac9a216f86ec010a3 http://rdf.ncbi.nlm.nih.gov/pubchem/patentassignee/MD5_8af19d05c71d306141bc1fdbd2f05f39 |
| classificationIPCInventive | http://rdf.ncbi.nlm.nih.gov/pubchem/patentipc/G01N27-62 |
| filingDate | 2013-08-21-04:00^^<http://www.w3.org/2001/XMLSchema#date> |
| inventor | http://rdf.ncbi.nlm.nih.gov/pubchem/patentinventor/MD5_17888d752223e759a6556a3bc6d33c14 http://rdf.ncbi.nlm.nih.gov/pubchem/patentinventor/MD5_bae6e993fdadcfc78d60bd127d9a0f78 |
| publicationDate | 2015-03-02-04:00^^<http://www.w3.org/2001/XMLSchema#date> |
| publicationNumber | JP-2015040757-A |
| titleOfInvention | SPECTRUM PREDICTION METHOD, SPECTRUM PREDICTION DEVICE, AND PROGRAM |
| abstract | A spectrum prediction method, a spectrum prediction apparatus, and a program for accurately predicting an MSn spectrum by simple calculation are provided. Information on the structure of a sugar molecule is read (step S502). A deprotonation probability is calculated by simulating deprotonation in the sugar molecule using the read information on the structure of the sugar molecule (step S504). An empirical fragmentation pattern is used to predict the fragment type generated by the deprotonation simulation (step S506). Information on the fragment type of the sugar molecule whose generation is simulated is stored (step S508). Based on the deprotonation probability and the predicted fragment information, the MSn spectrum of the sugar molecule is predicted (step S510). [Selection] Figure 6 |
| priorityDate | 2013-08-21-04:00^^<http://www.w3.org/2001/XMLSchema#date> |
| type | http://data.epo.org/linked-data/def/patent/Publication |
Incoming Links
Total number of triples: 35.