Adam's update from okeanos
authorCezary Czaplewski <czarek@chem.univ.gda.pl>
Sun, 22 Mar 2020 22:30:26 +0000 (23:30 +0100)
committerCezary Czaplewski <czarek@chem.univ.gda.pl>
Sun, 22 Mar 2020 22:30:26 +0000 (23:30 +0100)
commit5836ecdab5a8b95f079bbf6e07374dee3fce8a26
tree598f3971de00a0a7af849b5ce1502fc662a96200
parenta05e8996b6fb955dc21aef7a85db21ee73d0a9d3
Adam's update from okeanos
28 files changed:
source/cluster/wham/src-M-SAXS-homology/energy_p_new.F
source/unres/src-HCD-5D/COMMON.SPLITELE
source/unres/src-HCD-5D/COMMON.VECTORS
source/unres/src-HCD-5D/MD_A-MTS.F
source/unres/src-HCD-5D/Makefile_MPICH_ifort-okeanos
source/unres/src-HCD-5D/check_ecartint_CASC_NC.F [new file with mode: 0644]
source/unres/src-HCD-5D/checkder_p.F
source/unres/src-HCD-5D/elecont.f
source/unres/src-HCD-5D/energy_p_new-sep_barrier.F
source/unres/src-HCD-5D/energy_p_new_barrier.F
source/unres/src-HCD-5D/energy_p_new_barrier.F.safe
source/unres/src-HCD-5D/energy_split-sep.F
source/unres/src-HCD-5D/gen_rand_conf.F
source/unres/src-HCD-5D/gradient_p.F
source/unres/src-HCD-5D/lagrangian_lesyng.F
source/unres/src-HCD-5D/minimize_p.F
source/unres/src-HCD-5D/moments.F
source/unres/src-HCD-5D/readrtns_CSA.F
source/wham/src-M-SAXS-homology/COMMON.CONTMAT [new file with mode: 0644]
source/wham/src-M-SAXS-homology/COMMON.CORRMAT [new file with mode: 0644]
source/wham/src-M-SAXS-homology/Makefile_MPICH_ifort-okeanos
source/wham/src-M-SAXS-homology/cxread.F
source/wham/src-M-SAXS-homology/energy_p_new.F
source/wham/src-M-SAXS-homology/include_unres/COMMON.CONTACTS
source/wham/src-M-SAXS-homology/include_unres/COMMON.CONTACTS.safe [new file with mode: 0644]
source/wham/src-M-SAXS-homology/include_unres/COMMON.CONTMAT [new file with mode: 0644]
source/wham/src-M-SAXS-homology/include_unres/COMMON.CORRMAT [new file with mode: 0644]
source/wham/src-M-SAXS-homology/read_constr_homology.F