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- Thu Sep 08, 2011 1:36 pm
- Forum: A Python implementation of the multistate Bennett acceptance ratio (MBAR)
- Topic: pyMBAR for Temperature Replica Exchange
- Replies: 0
- Views: 541
pyMBAR for Temperature Replica Exchange
Hello All, I'm not sure if anyone is visiting these forums at all but I thought I'd still give it a try. I was wondering if there's a separate version of pyMBAR that would allow one to unbias the results of temperature replica exchange simulation. Sort of similar to what ptWHAM was doing. Thank you!