Mercurial > repos > bgruening > ctb_im_cluster_butina_matrix
directory /test-data/ @ 0:0332c2ff19f2 draft
| name | size | permissions |
|---|---|---|
| [up] | drwxr-xr-x | |
 Kinase_inhibs.sdf
|
70460 | -rw-r--r-- |
|
XChemReactionMaker1.sdf
|
209652 | -rw-r--r-- |
|
cluster_butina_matrix_output1.tsv
|
3853 | -rw-r--r-- |
|
cluster_butina_output1.sdf
|
102904 | -rw-r--r-- |
|
constrained_conf_gen_output1.sdf
|
400005 | -rw-r--r-- |
|
dhfr_3d.sdf
|
2501648 | -rw-r--r-- |
|
hits-17.sdf
|
21921 | -rw-r--r-- |
|
pbf_ev_output1.sdf
|
107645 | -rw-r--r-- |
|
poses.sdf
|
34037 | -rw-r--r-- |
|
pyrimethamine.mol
|
2301 | -rw-r--r-- |
|
ref_mol.sdf
|
1690 | -rw-r--r-- |
|
rxn_maker_output1.sdf
|
2910582 | -rw-r--r-- |
|
screen_output1.sdf
|
45352 | -rw-r--r-- |
|
screen_output2.sdf
|
66114 | -rw-r--r-- |
|
sdf-aliphatic-primary-amines-175.sdf
|
1324577 | -rw-r--r-- |
|
standardize_output1.sdf
|
102091 | -rw-r--r-- |
|
standardize_output2.sdf
|
102091 | -rw-r--r-- |
|
sulfonyl_chloride.sdf
|
1070 | -rw-r--r-- |