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GoldScores for the Docking of Taspine (1), Galanthamine, and Tacrine in Their Protonated and Neutral Forms into Different AChE Crystal Structures
| ligand | 1B41 | 1W6R | 1ACJ |
|---|---|---|---|
| taspine | 43.78 | 61.12 | 62.23 |
| taspine-protonated | 49.70 | 66.10 | 58.59 |
| galanthamine | 48.34 | 76.00 | 65.63 |
| galanthamine-protonated | 49.76 | 75.78 | 67.58 |
| tacrine | 57.24 | 60.37 | 58.04 |
| tacrine-protonated | 54.11 | 50.31 | 48.97 |
