Compound ID | VLA-UCB-05e51b3f-10 |
ΔG / kcal M-1 | −13.6 ± 0.3 |
IC50 / µM | TBD |
pIC50 | TBD |
RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distributions | Convergence | ||||||
---|---|---|---|---|---|---|---|---|---|---|---|
RUN184 | MAT-POS-8a69d52e-7_1 |
|
VLA-UCB-05e51b3f-10_1 |
|
2.4 ± 0.3 |
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