dhfr00039.sdf | searchcode

/data/set2/dhfr00039.sdf

http://github.com/rajarshi/cdkr
Unknown | 135 lines | 135 code | 0 blank | 0 comment | 0 complexity | da46e583d3f38c374b7bbef3f856b1c3 MD5 | raw file

3-14
  Cerius2 12180216023D 1   1.00000                          
 Structure written by MMmdl.
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M  CHG  2  25   1  27  -1
M  END
>  <Name>
3-14
>  <Family>
A
>  <PC_uM>
0.460000
>  <TG_uM>
0.007400
>  <RL_uM>
0.006800
>  <set>
0
$$$$