X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=examples%2Funres%2Fnew%2FREMD%2FNose-Hoover%2Fff_1l2y%2Ffort.2;fp=examples%2Funres%2Fnew%2FREMD%2FNose-Hoover%2Fff_1l2y%2Ffort.2;h=0000000000000000000000000000000000000000;hb=fe9e3a2f1191191edd529c64aba73f2b98723a47;hp=e8a026094cc00e47ef9e8f40846a1e2031d6da8c;hpb=c89d7d207940ebb57e0042cb35ab65d0f8a4b55e;p=unres.git

diff --git a/examples/unres/new/REMD/Nose-Hoover/ff_1l2y/fort.2 b/examples/unres/new/REMD/Nose-Hoover/ff_1l2y/fort.2
deleted file mode 100644
index e8a0260..0000000
--- a/examples/unres/new/REMD/Nose-Hoover/ff_1l2y/fort.2
+++ /dev/null
@@ -1,23 +0,0 @@
- Start reading THETA_PDB
- End reading THETA_PDB
-Nose-Hoover bath calculation
-Mol.Phys. 87 1117 (1996) Martyna et al.
-NVT-XI-RESPA algorithm
-                                                Temperature: 300.00000
-                                                         Q =   1.00000
- H0=    234.175071150677     
- acceleration/energy drift too large   60509.0840965407     
-   2009862066.08707       split increased to            2  itime      615542 
-  itsplit           1
- acceleration/energy drift too large   8.36108835545887     
-   10.3419285707564       split increased to            2  itime      992532 
-  itsplit           1
- acceleration/energy drift too large   10.5635007751565     
-   19.4216957429601       split increased to            2  itime      766305 
-  itsplit           1
- acceleration/energy drift too large   9.70781526288116     
-   14.4196992513867       split increased to            2  itime      793876 
-  itsplit           1
- acceleration/energy drift too large   16.5925673447319     
-   76.5976289448367       split increased to            2  itime      829316 
-  itsplit           1