Modified functionalization

Computer-Aided Drug Design at the Durrant Lab › Forums › AutoGrow4 › Modified functionalization

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    • July 29, 2023 at 3:04 am #149337
      Donnie
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      Hi!

      Is it possible for autogrow4 to functionalize only a selected part of the whole structure? Basically I need to keep a CORE structure and a pendant group constant and only have two designated R-groups for functionalization. Thank you!

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