Support for octahedral periodic boundary conditions?

The functionality of OpenMM will (eventually) include everything that one would need to run modern molecular simulation.
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Jonathan Saboury
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Joined: Fri Feb 24, 2012 11:48 am

Support for octahedral periodic boundary conditions?

Post by Jonathan Saboury » Wed Apr 17, 2013 11:01 am

Doesn't seem like it is supported yet, any plans on supporting it in the future?

Thanks, Jonathan
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Peter Eastman
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Joined: Thu Aug 09, 2007 1:25 pm

Re: Support for octahedral periodic boundary conditions?

Post by Peter Eastman » Wed Apr 17, 2013 11:44 am

It's on our list of features we plan to implement, though I can't say anything definite about when that will happen.

Peter
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