Update data/README.md
Browse files- data/README.md +2 -2
data/README.md
CHANGED
|
@@ -2,8 +2,8 @@
|
|
| 2 |
|
| 3 |
Each data entry in the AMAX-1 dataset is comprised of 4 columns. Examples and descriptions are detailed below.
|
| 4 |
|
| 5 |
-
| Column Index | Column Descriptor |
|
| 6 |
-
|
| 7 |
| 0 | compound | c1ccc2cc3ccccc3cc2c1 | ```str``` | The compound in question, represented as a SMILES string. |
|
| 8 |
| 1 | solvent | C1CCCCC1 | ```str``` | The solvent the compound is dissolved in, represented as a SMILES string. |
|
| 9 |
| 2 | lambda_max | 356.0 | ```float``` | The absorption maxima of the compound-solvent combination in nm. |
|
|
|
|
| 2 |
|
| 3 |
Each data entry in the AMAX-1 dataset is comprised of 4 columns. Examples and descriptions are detailed below.
|
| 4 |
|
| 5 |
+
| Column Index | Column Descriptor | Example | Data Type | Description |
|
| 6 |
+
|--------------|-------------------|---------|-----------|-------------|
|
| 7 |
| 0 | compound | c1ccc2cc3ccccc3cc2c1 | ```str``` | The compound in question, represented as a SMILES string. |
|
| 8 |
| 1 | solvent | C1CCCCC1 | ```str``` | The solvent the compound is dissolved in, represented as a SMILES string. |
|
| 9 |
| 2 | lambda_max | 356.0 | ```float``` | The absorption maxima of the compound-solvent combination in nm. |
|