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We probably want to use the online analysis functionality to update the estimate of binding free energy at the same interval as switch_experiment_interval for these systems. That will greatly simplify the near-real-time gathering of free energy estimate data for monitoring the progress and accuracy of these benchmarks.
The text was updated successfully, but these errors were encountered:
We probably want to use the online analysis functionality to update the estimate of binding free energy at the same interval as
switch_experiment_interval
for these systems. That will greatly simplify the near-real-time gathering of free energy estimate data for monitoring the progress and accuracy of these benchmarks.The text was updated successfully, but these errors were encountered: