diff options
| author | Andreas Maunz <andreas@maunz.de> | 2012-01-18 15:15:42 +0100 |
|---|---|---|
| committer | Andreas Maunz <andreas@maunz.de> | 2012-01-18 15:15:42 +0100 |
| commit | bdd5caa1eb3f7b14eb0acd30bf8200dcb750d49c (patch) | |
| tree | fe074e591a6dc72fb46b500c58f2175a7735fb8e /5x_cv/csv/MDD_geometrical.csv | |
| parent | 8d1c34e05e49aaff7536ae23d841b36466d4b310 (diff) | |
Added folder structure
Diffstat (limited to '5x_cv/csv/MDD_geometrical.csv')
| -rw-r--r-- | 5x_cv/csv/MDD_geometrical.csv | 1 |
1 files changed, 1 insertions, 0 deletions
diff --git a/5x_cv/csv/MDD_geometrical.csv b/5x_cv/csv/MDD_geometrical.csv new file mode 100644 index 0000000..1f2aa63 --- /dev/null +++ b/5x_cv/csv/MDD_geometrical.csv @@ -0,0 +1 @@ +SMILES,GRAV-6,GRAVH-2,GRAVH-3,LOBMIN,MOMI-X,MOMI-YZ,MOMI-XY,MOMI-Y,GRAV-1,MOMI-XZ,MOMI-Z,GRAV-2,GRAV-3,MOMI-R,GRAV-4,GRAV-5,GRAVH-1,LOBMAX |