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authorChristoph Helma <helma@in-silico.ch>2016-02-17 21:13:23 +0100
committerChristoph Helma <helma@in-silico.ch>2016-02-17 21:13:23 +0100
commit4d67ddb9fe72cb4cba42e508a943e1d4d04fef8c (patch)
tree7495d315e55521adcb1818bc97214b1096915d16 /paper/data/functional-groups-reduced.csv
parent0ab42bc04fefd4dd67b62c87dc651c90dc7988f0 (diff)
validations, figures, text finalisation started
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+Alkene,39,30
+Alkyne,5,8
+Alcohol,44,27
+Dialkylether,35,32
+Amine,66,41
+Aldehyde,3,1
+Ketone,21,25
+Enol,4,5
+Carboxylic_acid,33,38
+Lactone,11,10
+Carboxylic_acid_derivative,215,227
+Amide,38,60
+Lactam,12,18
+Amidine,3,4
+Nitrile,35,39
+Vinylogous_carbonyl_or_carboxyl_derivative,70,97
+Vinylogous_ester,113,120
+Carbonic_acid_derivatives,109,131
+Phenol,27,9
+Arylchloride,142,163
+Arylfluoride,22,41
+Heteroaromatic,147,205
+Nitro,42,31
+Sulfonic_derivative,24,29
+Sulfenic_derivative,48,34
+Phosphoric_acid_derivative,70,44
+Aromatic,402,396
+Heterocyclic,228,272
+Epoxide,11,2
+Annelated_rings,97,73
+Conjugated_double_bond,207,213
+Trifluoromethyl,44,63
+C_ONS_bond,520,484
+Salt,26,45 \ No newline at end of file