X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?p=unres.git;a=blobdiff_plain;f=examples%2Funres%2Fnew%2Fmicrocanonical%2FRESPA%2Fff_gab%2F1L2Y_micro_005.rst;fp=examples%2Funres%2Fnew%2Fmicrocanonical%2FRESPA%2Fff_gab%2F1L2Y_micro_005.rst;h=0000000000000000000000000000000000000000;hp=3cbbf44a81b47a09de2bc95b771fd36d0fa30af3;hb=2a226bfc86eabc6e4eae0c3ad1cbc3cb5417a05a;hpb=a0e685f844163003749ba91dfbf4644bcc8cfa30 diff --git a/examples/unres/new/microcanonical/RESPA/ff_gab/1L2Y_micro_005.rst b/examples/unres/new/microcanonical/RESPA/ff_gab/1L2Y_micro_005.rst deleted file mode 100644 index 3cbbf44..0000000 --- a/examples/unres/new/microcanonical/RESPA/ff_gab/1L2Y_micro_005.rst +++ /dev/null @@ -1,90 +0,0 @@ - 10000.0000001719 23.9220521729907 -41.1267066769857 - -17.2046545039950 300.000000000000 - 0.00000E+00 0.00000E+00 0.00000E+00 - 0.17790E+00 -0.12390E+00 -0.16956E+00 - 0.14663E+00 0.26776E+00 -0.12402E-01 - -0.14130E+00 -0.15704E+00 0.16987E+00 - 0.40473E-03 -0.41703E-01 -0.11270E+00 - -0.40425E-01 0.18542E+00 0.46768E-01 - -0.38216E-01 -0.25006E+00 0.60878E-01 - 0.40540E-01 0.14749E+00 -0.16152E+00 - 0.28116E-01 -0.32581E-01 0.60646E-01 - -0.22044E-01 -0.11586E+00 0.61520E-01 - 0.11777E-01 0.19641E+00 -0.20164E-01 - 0.13976E+00 -0.10168E+00 -0.33079E-01 - -0.30073E+00 -0.26537E-01 -0.11662E+00 - 0.68234E-01 0.23624E+00 0.16937E+00 - 0.16044E+00 -0.17576E+00 -0.30728E-01 - 0.17488E-01 0.10369E+00 0.95214E-01 - -0.13352E+00 -0.54430E-01 -0.20162E+00 - 0.14203E+00 -0.14892E+00 0.14819E+00 - -0.41299E+00 0.87804E-01 -0.76123E-01 - -0.12470E-02 -0.95139E-01 0.84458E-01 - 0.00000E+00 0.00000E+00 0.00000E+00 - 0.00000E+00 0.00000E+00 0.00000E+00 - 0.00000E+00 0.00000E+00 0.00000E+00 - 0.31801E-01 -0.63590E-01 -0.10874E+00 - -0.70110E-01 0.10818E+00 0.41790E-02 - -0.11040E+00 -0.14633E+00 0.83078E-01 - -0.12236E+00 0.45039E-01 -0.17896E-01 - -0.78463E-01 0.66167E-01 -0.73430E-01 - 0.99400E-01 -0.18088E+00 -0.22110E-01 - -0.15612E+00 0.11394E+00 -0.80506E-01 - 0.60183E-01 -0.44153E-01 0.80604E-01 - -0.52645E-01 0.14418E+00 -0.56614E-01 - 0.00000E+00 0.00000E+00 0.00000E+00 - 0.00000E+00 0.00000E+00 0.00000E+00 - -0.35082E+00 0.37143E-01 0.73541E-02 - 0.50111E-01 0.67198E-02 0.65135E-01 - 0.60084E-01 -0.83593E-01 -0.66070E-01 - 0.00000E+00 0.00000E+00 0.00000E+00 - -0.14170E+00 -0.40633E-01 -0.12718E+00 - 0.54453E-01 -0.44742E-01 0.12399E+00 - -0.11937E+00 0.89696E-01 -0.49348E-01 - 0.16860E+00 -0.18012E-01 -0.64635E-01 - 0.13050E+00 0.25381E+00 -0.27734E-01 - 0.00000E+00 0.00000E+00 0.00000E+00 - 0.38000E+01 0.00000E+00 0.00000E+00 - 0.52149E-01 -0.25796E+01 0.27770E+01 - -0.33725E+01 0.10244E+00 0.16809E+01 - -0.12625E+01 -0.20490E+01 0.29422E+01 - -0.58283E-01 -0.33174E+01 -0.19383E+01 - 0.37557E+01 0.13893E+00 -0.50069E+00 - 0.51803E+00 0.95333E+00 0.36536E+01 - -0.13695E+01 -0.32544E+01 0.14674E+01 - 0.16409E+01 -0.20134E+01 -0.27884E+01 - 0.28965E+01 -0.74639E+00 0.22592E+01 - -0.11168E+00 0.27415E+01 0.26045E+01 - 0.10100E+01 0.26924E+01 -0.25004E+01 - 0.15907E+01 -0.22340E+01 -0.26162E+01 - -0.87382E+00 0.73121E+00 -0.36627E+01 - 0.20525E+01 0.11103E+01 -0.29060E+01 - -0.13654E+01 0.35141E+01 -0.11773E+00 - 0.17958E+01 0.24916E+01 0.21909E+01 - -0.10157E+01 -0.90227E-01 0.36743E+01 - -0.17017E+01 0.31387E+01 0.14947E+01 - 0.61836E+00 -0.10901E+01 0.35604E+01 - 0.37054E+01 0.10728E+00 -0.83576E+00 - 0.00000E+00 0.00000E+00 0.00000E+00 - 0.00000E+00 0.00000E+00 0.00000E+00 - 0.11397E+01 0.91861E+00 -0.86536E+00 - 0.18746E+01 -0.51146E+00 0.56084E+00 - -0.22799E+01 -0.45534E+00 -0.72942E+00 - -0.13660E+01 0.43796E+00 0.10717E+01 - -0.17317E+01 -0.51525E+00 -0.12723E+01 - -0.11954E+01 0.14366E+01 -0.17723E+01 - 0.48245E+00 0.18626E+01 -0.50035E+00 - -0.72347E+00 -0.81960E+00 0.22986E+01 - -0.27317E+00 0.43594E+00 -0.16719E+01 - 0.00000E+00 0.00000E+00 0.00000E+00 - 0.00000E+00 0.00000E+00 0.00000E+00 - 0.10378E+01 0.42977E+00 0.78237E+00 - 0.32155E+00 -0.99180E+00 0.49587E+00 - -0.90313E+00 0.73065E+00 0.84658E-02 - 0.00000E+00 0.00000E+00 0.00000E+00 - -0.28428E+01 -0.35636E+00 -0.98306E+00 - -0.22579E+00 0.55668E+00 -0.12013E+01 - 0.12239E+01 -0.40460E+00 0.37301E+00 - -0.10902E+01 -0.57437E+00 -0.50186E+00 - -0.87294E+00 -0.72165E+00 -0.35073E+00 - 0.00000E+00 0.00000E+00 0.00000E+00