unres4.git
6 years agosmall fixes f90 to F90 correction master
Cezary Czaplewski [Wed, 28 Mar 2018 11:05:10 +0000 (13:05 +0200)]
small fixes f90 to F90 correction

6 years agoctest checkgrad
Cezary Czaplewski [Wed, 28 Mar 2018 09:42:16 +0000 (11:42 +0200)]
ctest checkgrad

6 years agosmall fixes
Emilia Lubecka [Fri, 23 Mar 2018 15:08:43 +0000 (16:08 +0100)]
small fixes

6 years agorename
Emilia Lubecka [Fri, 23 Mar 2018 14:06:54 +0000 (15:06 +0100)]
rename

6 years agoctest and PARAM update
Cezary Czaplewski [Mon, 19 Mar 2018 08:24:00 +0000 (09:24 +0100)]
ctest and PARAM update

7 years agosmall cleaning
Emilia Lubecka [Fri, 10 Mar 2017 14:12:58 +0000 (15:12 +0100)]
small cleaning

7 years agonumerical gradient delta 10e-4
Cezary Czaplewski [Thu, 23 Feb 2017 05:31:50 +0000 (06:31 +0100)]
numerical gradient delta 10e-4

7 years agoetor & etor_d multichain match prerelease
Cezary Czaplewski [Fri, 17 Feb 2017 08:24:41 +0000 (09:24 +0100)]
etor & etor_d multichain match prerelease

7 years agoenergy match prerelease from old unres
Cezary Czaplewski [Thu, 16 Feb 2017 08:59:58 +0000 (09:59 +0100)]
energy match prerelease from old unres

7 years agocmake for unres4 cluster
Cezary Czaplewski [Wed, 15 Feb 2017 09:02:28 +0000 (10:02 +0100)]
cmake for unres4 cluster

7 years agocmake for unres4 wham
Cezary Czaplewski [Wed, 15 Feb 2017 08:22:39 +0000 (09:22 +0100)]
cmake for unres4 wham

some files changed from .f90 to .F90
necessary for dependencies

7 years agocmake for unres4 - the first version, unres only no tests
Cezary Czaplewski [Wed, 15 Feb 2017 05:25:11 +0000 (06:25 +0100)]
cmake for unres4 - the first version, unres only no tests

7 years agocorrections from emilial
Cezary Czaplewski [Tue, 14 Feb 2017 05:13:11 +0000 (06:13 +0100)]
corrections from emilial

7 years agocorrections of maxres2 in c array
Emilia Lubecka [Fri, 16 Dec 2016 10:06:03 +0000 (11:06 +0100)]
corrections of maxres2 in c array

7 years agopopr. tab w sum_gradient
Emilia Lubecka [Thu, 15 Dec 2016 12:22:15 +0000 (13:22 +0100)]
popr. tab w sum_gradient

7 years agounres_package_Oct_2016 from emilial
Cezary Czaplewski [Fri, 14 Oct 2016 19:12:21 +0000 (21:12 +0200)]
unres_package_Oct_2016 from emilial

8 years agobug fix in SCcorr gradient release
Adam Sieradzan [Fri, 17 Jul 2015 12:16:20 +0000 (14:16 +0200)]
bug fix in SCcorr gradient

8 years agoadded v4.0 sources v4.0
Dawid Jagieła [Wed, 15 Jul 2015 18:00:54 +0000 (20:00 +0200)]
added v4.0 sources