Template:MassBank/Matrix
From Metabolomics.JP
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---Register Ions--- | ---Register Ions--- | ||
---全ページのイオンヘッダーにおける頻度を登録。最初の要素はページ名--- | ---全ページのイオンヘッダーにおける頻度を登録。最初の要素はページ名--- | ||
− | for id, frag in stdin:gmatch("&&([%a%d]+)&&([%S]+)") do | + | for id, frag in stdin:gmatch("&&[%d-]+&&([%a%d]+)&&([%S]+)") do |
table.insert(Name, id) | table.insert(Name, id) | ||
T = {} | T = {} |
Revision as of 21:18, 30 June 2009
General Index | Ion Frequency | Prec.-Product | Neutral Loss | Help |
IDs and Links | |
---|---|
MassBank | MassBank/Matrix |
CAS | |
Keio ID |
Contents |
Top 10 Similar Molecules of MassBank/Matrix
Similarity score is defined as the sum of Shannon entropy of shared ionic formulas.
Links
Annotations
Precursor | Product | Comments |
---|---|---|
(0) | (0) | CHClFINOPS |
Precursor-Product Relationship
The matrix is viewed columnwise. The topmost precursor ion in bold face produces the product ions beneath it. Each formula in matrix cells corresponds to the neutral loss. Blackout cells indicate products that cannot be derived, and orange cells indicate a structurally plausible link produced by cleaving a single chemical bond (in cases of ring-opening, two bonds).
No "ION INFO" line in the form &&(formula)&&(formula)&&...&&
ID: MassBank/Matrix | 210 CHClFIONSP |
210 CHClFIONSP |
|