[gmx-users] MBAR bootstrap
thanh.q.le at sjsu.edu
Wed Jan 10 04:01:55 CET 2018
I have a question regarding using bootstrap for MBAR.
After running 30 windows for the complex and 20 windows for the ligand, 100 ns each, I have a problem trying to do bootstrap (based on what I have read, bootstrap sampling is recommended to analyze results from MBAR)
Can anyone point me to the correct direction to implement bootstrap? Or any advice on how to analyze MBAR?
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