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/data/set2/dhfr00032.sdf

http://github.com/rajarshi/cdkr
Unknown | 110 lines | 110 code | 0 blank | 0 comment | 0 complexity | 75e19f4a770ba6cdaf6606b0fbfa0ec5 MD5 | raw file
  1. 2-24a
  2. Cerius2 12180216023D 1 1.00000
  3. Structure written by MMmdl.
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  97. M END
  98. > <Name>
  99. 2-24a
  100. > <Family>
  101. A
  102. > <PC_uM>
  103. 0.120000
  104. > <TG_uM>
  105. 0.070000
  106. > <RL_uM>
  107. 0.630000
  108. > <set>
  109. 1
  110. $$$$