How to save molecules in a sdf file as 2D images

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Andrew Orry

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Dec 9, 2024, 10:50:29 PM12/9/24
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Q How to save molecules in a sdf file as 2D images
A.
- File/Open sdf file and it will be displayed as an ICM chemical table
- Then copy and paste the script below into the ICM terminal window = edit 't' in the script to the name of your chemical table

for i=1,Nof(t)
  write image t.mol[i] "chem_" + i + ".png" window=800//600
endfor



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