VLA-UCB-50c39ae8-10

molecule

Data

Compound ID VLA-UCB-50c39ae8-10
ΔG / kcal M-1 −6.1 ± 0.4
IC50 / µM TBD
pIC50 TBD

Transformations

RUN Initial microstate Final microstate ΔΔG / kcal M-1 Work distributions Convergence
RUN36 MAT-POS-8a69d52e-7_1 molecule VLA-UCB-50c39ae8-10_1 molecule −1.7 ± 0.2 work distributions convergence plot
RUN35 MAT-POS-8a69d52e-7_1 molecule VLA-UCB-50c39ae8-10_1 molecule 1.9 ± 0.4 work distributions convergence plot
Last updated 2020-11-12T00:51:49.055784+00:00
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