X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=examples%2Funres%2FMD%2Fwith_constrains%2FBerendsen%2Fff_gab%2Foutputs%2F1L2Y_MD_GB003.stat;h=298bb8c2770d3bdb877bff2127940acab3c2e10c;hb=0f881114c90e71a886f1c0d1fcdf573e9d3d7b77;hp=a8d6bbb7baa4d5dfe3794e8967867d69ab124d42;hpb=973e30c3fc3444f4e49450c68a510ce149896509;p=unres.git diff --git a/examples/unres/MD/with_constrains/Berendsen/ff_gab/outputs/1L2Y_MD_GB003.stat b/examples/unres/MD/with_constrains/Berendsen/ff_gab/outputs/1L2Y_MD_GB003.stat index a8d6bbb..298bb8c 100644 --- a/examples/unres/MD/with_constrains/Berendsen/ff_gab/outputs/1L2Y_MD_GB003.stat +++ b/examples/unres/MD/with_constrains/Berendsen/ff_gab/outputs/1L2Y_MD_GB003.stat @@ -1,101 +1,101 @@ - 0 0.00 30.203 662.810 693.012 0.00 1.000 0.000 0.308 8.660 274.015 300.000 7.001 3 - 10000 2000.00 36.454 -24.511 11.943 5.83 0.214 0.500 0.189 1.042 330.729 300.000 10.059 3 - 20000 4000.00 27.678 -34.625 -6.946 2.99 0.357 0.444 0.258 1.748 251.112 300.000 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