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Diffstat (limited to 'paper/data/functional-groups-reduced4R.csv')
| -rw-r--r-- | paper/data/functional-groups-reduced4R.csv | 68 |
1 files changed, 68 insertions, 0 deletions
diff --git a/paper/data/functional-groups-reduced4R.csv b/paper/data/functional-groups-reduced4R.csv new file mode 100644 index 0000000..e37c41d --- /dev/null +++ b/paper/data/functional-groups-reduced4R.csv @@ -0,0 +1,68 @@ +Alkene, 39, Mazzatorta +Alkene, 30, Swiss Federal Office +Alkyne, 5, Mazzatorta +Alkyne, 8, Swiss Federal Office +Alcohol, 44, Mazzatorta +Alcohol, 27, Swiss Federal Office +Dialkylether, 35, Mazzatorta +Dialkylether, 32, Swiss Federal Office +Amine, 66, Mazzatorta +Amine, 41, Swiss Federal Office +Aldehyde, 3, Mazzatorta +Aldehyde, 1, Swiss Federal Office +Ketone, 21, Mazzatorta +Ketone, 25, Swiss Federal Office +Enol, 4, Mazzatorta +Enol, 5, Swiss Federal Office +Carboxylic_acid, 33, Mazzatorta +Carboxylic_acid, 38, Swiss Federal Office +Lactone, 11, Mazzatorta +Lactone, 10, Swiss Federal Office +Carboxylic_acid_derivative, 215, Mazzatorta +Carboxylic_acid_derivative, 227, Swiss Federal Office +Amide, 38, Mazzatorta +Amide, 60, Swiss Federal Office +Lactam, 12, Mazzatorta +Lactam, 18, Swiss Federal Office +Amidine, 3, Mazzatorta +Amidine, 4, Swiss Federal Office +Nitrile, 35, Mazzatorta +Nitrile, 39, Swiss Federal Office +Vinylogous_carbonyl_or_carboxyl_derivative, 70, Mazzatorta +Vinylogous_carbonyl_or_carboxyl_derivative, 97, Swiss Federal Office +Vinylogous_ester, 113, Mazzatorta +Vinylogous_ester, 120, Swiss Federal Office +Carbonic_acid_derivatives, 109, Mazzatorta +Carbonic_acid_derivatives, 131, Swiss Federal Office +Phenol, 27, Mazzatorta +Phenol, 9, Swiss Federal Office +Arylchloride, 142, Mazzatorta +Arylchloride, 163, Swiss Federal Office +Arylfluoride, 22, Mazzatorta +Arylfluoride, 41, Swiss Federal Office +Heteroaromatic, 147, Mazzatorta +Heteroaromatic, 205, Swiss Federal Office +Nitro, 42, Mazzatorta +Nitro, 31, Swiss Federal Office +Sulfonic_derivative, 24, Mazzatorta +Sulfonic_derivative, 29, Swiss Federal Office +Sulfenic_derivative, 48, Mazzatorta +Sulfenic_derivative, 34, Swiss Federal Office +Phosphoric_acid_derivative, 70, Mazzatorta +Phosphoric_acid_derivative, 44, Swiss Federal Office +Aromatic, 402, Mazzatorta +Aromatic, 396, Swiss Federal Office +Heterocyclic, 228, Mazzatorta +Heterocyclic, 272, Swiss Federal Office +Epoxide, 11, Mazzatorta +Epoxide, 2, Swiss Federal Office +Annelated_rings, 97, Mazzatorta +Annelated_rings, 73, Swiss Federal Office +Conjugated_double_bond, 207, Mazzatorta +Conjugated_double_bond, 213, Swiss Federal Office +Trifluoromethyl, 44, Mazzatorta +Trifluoromethyl, 63, Swiss Federal Office +C_ONS_bond, 520, Mazzatorta +C_ONS_bond, 484, Swiss Federal Office +Salt, 26, Mazzatorta +Salt, 45, Swiss Federal Office |