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Molecular Dynamics
Jump to new posts Re: My PBC box length keeps growing... by jtyang @ Today at 07:19 AM

Thank you very much! Now the new NVT ensemble MD is running.
Installation and Testing
Jump to new posts Re: Installation on Mac error by rmv @ 04/20/18 01:48 PM

In a terminal window, run these two commands: which gcc gcc --version Apple provides gcc, either as part of Xcode, or via the command line gcc tools that can be obtained separately. I've always found it best to use the Apple versions, and have not
Installation and Testing
Jump to new posts Re: RDC by rmv @ 04/19/18 12:38 PM

You need at least c42b1 for the RDC command.