Revision as of 09:00, 1 July 2009

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Ranitidine

Top 10 Similar Molecules of Ranitidine

[show] Ranking	About scoring
KOX00648p Score:10.72 KOX00890p Score:6.23 KOX00736p Score:5.53 KOX00245p Score:5.53 KOX00241p Score:5.53 KOX00197p Score:5.53 KOX00124p Score:5.53 KOX00911p Score:4.49 KOX00848p Score:4.49 KOX00793p Score:4.49	The similarity score between two molecules is defined as the sum of Shannon entropy of ionic formulas shared by the molecules: $\textstyle - \sum_{p\in shared} \log(\mbox{frequency}(p))$ 代謝物間の類似度スコアは、それらのスペクトルで共有される（アノテートされた）イオン式のシャノン情報量の総和です。

[show] Page list for each fragment
Pages Related to Peak C5H10N2: KOX00648p KOX00890p Pages Related to Peak C5H9N2: KOX00024p KOX00086p KOX00138p KOX00229p KOX00233p KOX00308p KOX00396p KOX00478p KOX00648p KOX00653p KOX00676p KOX00750p KOX00791p KOX00793p KOX00848p KOX00911p Pages Related to Peak C5H5O: KOX00124p KOX00197p KOX00241p KOX00245p KOX00736p

[show] About the PP Table (行列表示について)

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 &&C13H23N4O3S&&C11H16N3O3S&&C5H10N3O2S&&C8H12NOS&&C5H10N3O2&&C4H8N3O2&&C6H5OS&&C5H10N2&&C5H9N2&&C5H5O&&
-&&C13H23N4O3S: C11H16N3O3S C5H10N3O2S C8H12NOS C5H10N3O2 C4H8N3O2
+&&C13H23N4O3S: C11H16N3O3S C5H10N3O2S C8H12NOS C5H10N3O2 C4H8N3O2 C6H5OS** C5H10N2** C5H9N2** C5H5O**
-&&C11H16N3O3S: C5H10N3O2S C5H10N3O2 C4H8N3O2 C6H5OS C5H5O
+&&C11H16N3O3S: C5H10N3O2S C8H12NOS* C5H10N3O2 C4H8N3O2 C6H5OS C5H10N2** C5H9N2** C5H5O
-&&C5H10N3O2S: C4H8N3O2
+&&C5H10N3O2S: C5H10N3O2* C4H8N3O2 C5H10N2** C5H9N2** C5H5O*
-&&C8H12NOS: C6H5OS
+&&C8H12NOS: C6H5OS C5H5O**
-&&C5H10N3O2: C5H10N2 C5H9N2
+&&C5H10N3O2: C4H8N3O2* C5H10N2 C5H9N2 C5H5O*
+&&C6H5OS: C5H5O*
+&&C5H10N2: C5H9N2*
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