Extended Search of Analogs via Bioisosteric Replacements: Revision history

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21 September 2023

  • curprev 06:4106:41, 21 September 2023‎ Iamkaant talk contribs‎ 3,363 bytes +318‎ disclaimer added
  • curprev 06:1606:16, 21 September 2023‎ Iamkaant talk contribs‎ 3,045 bytes +3,045‎ Created page with "=== Rationale === Our standard pipeline of searching for analogs (at least as I know it) consists of entering the SMILES of a molecule of interest into all flavors of SmallWorld and Arthor, available in the lab. This procedure has two drawbacks: # Limited diversity. SmallWorld's and Arthor's measure of distance between the analogs and the parent compound is graph edit distance.<ref>I am probably using slightly wrong terminology here, so be it. You can learn more about..."
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