Mercurial > repos > bgruening > chemfp
diff chemfp_ob2fps/test-data/CID_2244_FP4.fps @ 0:a8ac5250d59c
Uploaded
author | bgruening |
---|---|
date | Tue, 26 Mar 2013 13:05:41 -0400 |
parents | |
children |
line wrap: on
line diff
--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/chemfp_ob2fps/test-data/CID_2244_FP4.fps Tue Mar 26 13:05:41 2013 -0400 @@ -0,0 +1,7 @@ +#FPS1 +#num_bits=307 +#type=OpenBabel-FP4/1 +#software=OpenBabel/2.3.1 +#source=CID_2244.sdf +#date=2012-05-15T16:59:22 +010000000000000000009800000000004001000000000000000000000000000000000240402801 2244