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Brian Kelley c756aff4f9 [CONTRIB]: Freewilson now keeps the coordinates passed in (#8868) 
* Freewilson now keeps the coordinates passed in

* Add better 3D reconstruction test
2025-11-01 06:28:52 +01:00
..
CHEMBL2321810_act.csv
Contribute FreeWilson analysis (#4026)
2021-04-19 14:41:14 +02:00
CHEMBL2321810_scaffold.mol
Contribute FreeWilson analysis (#4026)
2021-04-19 14:41:14 +02:00
CHEMBL2321810.smi
Contribute FreeWilson analysis (#4026)
2021-04-19 14:41:14 +02:00
cmet_ligands.sdf
[CONTRIB]: Freewilson now keeps the coordinates passed in (#8868)
2025-11-01 06:28:52 +01:00