Template:MassBank/Matrix
From Metabolomics.JP
(Difference between revisions)
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end | end | ||
fragments[head] = y | fragments[head] = y | ||
− | + | else if (head == nil) then | |
− | + | print('<span style="color:red">Parent ion for '..tail..' does not exist.</span>') | |
− | + | else | |
− | + | print('<span style="color:red">Product ion for '..head..' does not exist.</span>') | |
end | end | ||
end | end |
Revision as of 11:53, 8 June 2009
General Index | Ion Frequency | Prec.-Product | Neutral Loss | Help |
Contents |
Top 10 Similar Molecules
Similarity score is defined as the sum of Shannon entropy of shared ionic formulas.
- MassBank:KOX00662p Score:19.04
- MassBank:KOX00276p Score:19.04
- MassBank:KOX00039p Score:10.76
- MassBank:KOX00795p Score:8.27
- MassBank:KOX00740p Score:8.27
- MassBank:KOX00739p Score:8.27
- MassBank:KOX00547p Score:8.27
- MassBank:KOX00292p Score:8.27
- MassBank:KOX00102p Score:8.27
- MassBank:KOX00700p Score:5.38
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).
./lua: /tmp/mw_ex_lua_XOuSoP:124: 'end' expected (to close 'for' at line 48) near '<eof>'