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Algorithmic Fragment Elaboration

Jasmin Aschenbrenner edited this page Aug 6, 2024 · 2 revisions

Fragmenstein

Fragmenstein is a software (tool) used by DLS team in this project to suggest fragment merged compounds. To know more about this software, read here

The Fragalysis links for curation of several compounds set related to Hadia's curation are here:

1- Fstein_pures_others_batch

https://fragalysis.diamond.ac.uk/viewer/react/projects/266/239

2- Fstein_frag_pair_pur-2024-04-05-A v.1.2

https://fragalysis.diamond.ac.uk/viewer/react/projects/273/246

3- Fstein_pures_adenine-2024-04-05-A v.1.2

https://fragalysis.diamond.ac.uk/viewer/react/projects/281/254

4- SeeSAR_Manual-2024-04-04-C v.1.2 Jasmin’s library

https://fragalysis.diamond.ac.uk/viewer/react/projects/282/255

5-SeeSAR_Manual-2024-04-04-B v.1.2-Daren’s library

https://fragalysis.diamond.ac.uk/viewer/react/projects/283/256

6-Fstein_pures_ade2_ba-2024-04-05-A v.1.2

https://fragalysis.diamond.ac.uk/viewer/react/projects/293/260

7-Fstein_pures_oxyanio-2024-04-05-A v.1.2

https://fragalysis.diamond.ac.uk/viewer/react/projects/294/261

8- Fstein_pures_arg144-2024-04-08-A v.1.2

https://fragalysis.diamond.ac.uk/viewer/react/projects/298/265

9-Fstein_Rahman_pures-2024-04-08-A v.1.2

https://fragalysis.diamond.ac.uk/viewer/react/projects/299/266

10-Fstein_Rahman_REAL-2024-04-08-A v.1.2

https://fragalysis.diamond.ac.uk/viewer/react/projects/300/267

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