Invention Grant
- Patent Title: Three-dimensional spectral data processing device and processing method
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Application No.: US15536477Application Date: 2015-01-26
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Publication No.: US10598639B2Publication Date: 2020-03-24
- Inventor: Yuriko Nakakimura
- Applicant: Shimadzu Corporation
- Applicant Address: JP Nishinokyo-Kuwabaracho, Nakagyo-ku, Kyoto-shi, Kyoto
- Assignee: Shimadzu Corporation
- Current Assignee: Shimadzu Corporation
- Current Assignee Address: JP Nishinokyo-Kuwabaracho, Nakagyo-ku, Kyoto-shi, Kyoto
- Agency: Muir Patent Law, PLLC
- International Application: PCT/JP2015/051966 WO 20150126
- International Announcement: WO2016/120958 WO 20160804
- Main IPC: G01N30/86
- IPC: G01N30/86 ; H01J49/00 ; G01N30/72

Abstract:
When performing an analysis of the difference between a specific sample group and a nonspecific sample group, a principle component analysis processing unit (33) performs principle component analysis on a collection of a plurality of mass spectrums created from data obtained for a single specific sample, and a characteristic spectrum acquisition unit (34) acquires a characteristic spectrum for each of a plurality of principle components using factor loadings. A spectrum similarity calculation unit (35) calculates the similarities between all mass spectrums and the characteristic spectrum for each sample, and obtains a representative value for the same. The similarity representative value for each sample is obtained for all the characteristic spectrums. A difference determination unit (36) checks whether there is a significant difference between the distribution of the similarity representative values of the specific sample group and the distribution of the similarity representative values of the nonspecific sample group and determines that the characteristic spectrum which is the source of the similarities having a significant difference is a difference spectrum. The difference spectrum reflects component information characterizing a sample group difference, so a component identification unit (37) searches for the difference spectrum in a library to identify a component. This makes it possible to perform different analysis without performing spectrum peak detection.
Public/Granted literature
- US20170356889A1 THREE-DIMENSIONAL SPECTRAL DATA PROCESSING DEVICE AND PROCESSING METHOD Public/Granted day:2017-12-14
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