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  • * [[Replica exchange]] with MD and MC <cite>Proteins2007</cite> ...lica exchange simulations]] (REXMD). If you just want to run multithreaded simulations just use the standard binaries (which are all compiled with [http://www.ope
    8 KB (1,118 words) - 13:49, 13 November 2008
  • ...ably does not work. However, they are ''only'' needed for replica exchange simulations and there are no test cases for those anyway. -M use mpi (replica exchange) binaries [${USE_MPI}]
    4 KB (608 words) - 15:41, 8 December 2008