X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?p=unres.git;a=blobdiff_plain;f=examples%2Funres%2Fnew%2FREMD%2Fwith_constrains%2FBerendsen%2Fff_1l2y%2Ffort.2;fp=examples%2Funres%2Fnew%2FREMD%2Fwith_constrains%2FBerendsen%2Fff_1l2y%2Ffort.2;h=0000000000000000000000000000000000000000;hp=1d5fbf5250a2bb6a33b332e018ad2ece19ed9200;hb=2a226bfc86eabc6e4eae0c3ad1cbc3cb5417a05a;hpb=a0e685f844163003749ba91dfbf4644bcc8cfa30

diff --git a/examples/unres/new/REMD/with_constrains/Berendsen/ff_1l2y/fort.2 b/examples/unres/new/REMD/with_constrains/Berendsen/ff_1l2y/fort.2
deleted file mode 100644
index 1d5fbf5..0000000
--- a/examples/unres/new/REMD/with_constrains/Berendsen/ff_1l2y/fort.2
+++ /dev/null
@@ -1,110 +0,0 @@
- Start reading THETA_PDB
- End reading THETA_PDB
- j           2  k           3
- j           2  k           4
- j           2  k           5
- j           2  k           6
- j           2  k           7
- j           2  k           8
- j           2  k           9
- j           2  k          10
- j           3  k           4
- j           3  k           5
- j           3  k           6
- j           3  k           7
- j           3  k           8
- j           3  k           9
- j           3  k          10
- j           4  k           5
- j           4  k           6
- j           4  k           7
- j           4  k           8
- j           4  k           9
- j           4  k          10
- j           5  k           6
- j           5  k           7
- j           5  k           8
- j           5  k           9
- j           5  k          10
- j           6  k           7
- j           6  k           8
- j           6  k           9
- j           6  k          10
- j           7  k           8
- j           7  k           9
- j           7  k          10
- j           8  k           9
- j           8  k          10
- j           9  k          10
- acceleration/energy drift too large   6.22700722506562     
-   44.5137346493434       split increased to            2  itime      234715 
-  itsplit           1
- acceleration/energy drift too large   6.86814035347406     
-   12.4746903563092       split increased to            2  itime      514594 
-  itsplit           1
- acceleration/energy drift too large   6.55925793931436     
-   15.8656739496644       split increased to            2  itime      653285 
-  itsplit           1
- acceleration/energy drift too large   21.9080212609904     
-   313.864278107703       split increased to            2  itime      716644 
-  itsplit           1
- acceleration/energy drift too large   7.05820437593023     
-   65.2498780261722       split increased to            2  itime      766874 
-  itsplit           1
- acceleration/energy drift too large   3.27399071955341     
-   11.2118420753555       split increased to            2  itime      766875 
-  itsplit           1
- acceleration/energy drift too large   1.65659624160402     
-   12.8042137151367       split increased to            4  itime      766875 
-  itsplit           1
- acceleration/energy drift too large   3.73456721524056     
-   16.0028892511076       split increased to            2  itime      774313 
-  itsplit           1
- acceleration/energy drift too large   31.2190662301148     
-   1043.16119124700       split increased to            2  itime      997277 
-  itsplit           1
- acceleration/energy drift too large   4.45187640165009     
-   25.3192539827523       split increased to            2  itime      805374 
-  itsplit           1
- acceleration/energy drift too large   2.68717091115819     
-   36.2762846456559       split increased to            4  itime      805374 
-  itsplit           1
- acceleration/energy drift too large   8.91951026538456     
-   111.515595256629       split increased to            2  itime      821660 
-  itsplit           1
- acceleration/energy drift too large   7.49222623976741     
-   75.0988053069829       split increased to            2  itime      821661 
-  itsplit           1
- acceleration/energy drift too large   1.99475931907040     
-   18.8634159986581       split increased to            4  itime      821661 
-  itsplit           1
- acceleration/energy drift too large   5.16826042460590     
-   14.6364245545982       split increased to            2  itime      956637 
-  itsplit           1
- acceleration/energy drift too large   25.6524452006942     
-   1551.25820320037       split increased to            4  itime      956637 
-  itsplit           1
- acceleration/energy drift too large   2.16828666529408     
-   44.6707268674785       split increased to            8  itime      956637 
-  itsplit           2
- acceleration/energy drift too large   21.2081722872122     
-   297.396114249498       split increased to            2  itime      986672 
-  itsplit           1
- acceleration/energy drift too large   8.48518344407397     
-   89.2680392034545       split increased to            2  itime      940478 
-  itsplit           1
- acceleration/energy drift too large   11.7573043539954     
-   165.806730390708       split increased to            2  itime      965074 
-  itsplit           1
- acceleration/energy drift too large   14.1428555082260     
-   113.618783892170       split increased to            2  itime      986882 
-  itsplit           1
- acceleration/energy drift too large   4.24716564125084     
-   11.8604415785879       split increased to            2  itime      948935 
-  itsplit           1
- acceleration/energy drift too large   8.54598969321150     
-   41.5549594389274       split increased to            2  itime      958178 
-  itsplit           1
- acceleration/energy drift too large   4.65997608591955     
-   13.4883010927308       split increased to            2  itime      882204 
-  itsplit           1