DAR-DIA-23e5a6a0-3

molecule

Data

Compound ID DAR-DIA-23e5a6a0-3
ΔG / kcal M-1 −9.4 ± 0.6
IC50 / µM TBD
pIC50 TBD

Transformations

RUN Initial microstate Final microstate ΔΔG / kcal M-1 Work distributions Convergence
RUN14 MAT-POS-8a69d52e-7_1 molecule DAR-DIA-23e5a6a0-3_1 molecule −1.8 ± 0.7 work distributions convergence plot
RUN59 MAT-POS-8a69d52e-7_1 molecule DAR-DIA-23e5a6a0-3_2 molecule −0.7 ± 0.4 work distributions convergence plot
Last updated 2020-11-12T00:51:49.055784+00:00
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