pdbread & boxshift
authorCezary Czaplewski <czarek@chem.univ.gda.pl>
Wed, 1 Apr 2020 18:42:29 +0000 (20:42 +0200)
committerCezary Czaplewski <czarek@chem.univ.gda.pl>
Wed, 1 Apr 2020 18:42:29 +0000 (20:42 +0200)
commit566219e74d5310efba22c5a154c9075d971f6603
tree9c6c862e5ff93c33596704b61165f00e343c3730
parent085f8af583814a2d38448f89cbc99771c46ef922
pdbread & boxshift
23 files changed:
CMakeLists.txt
source/cluster/wham/src-HCD-5D/DIMENSIONS
source/cluster/wham/src-HCD-5D/Makefile-MPICH-ifort-okeanos
source/cluster/wham/src-HCD-5D/readpdb.F
source/unres/src-HCD-5D/CMakeLists.txt
source/unres/src-HCD-5D/Makefile_MPICH_ifort-okeanos
source/unres/src-HCD-5D/boxshift.f [new file with mode: 0644]
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/gen_rand_conf.F
source/unres/src-HCD-5D/int_from_cart.F [new file with mode: 0644]
source/unres/src-HCD-5D/make-tau.log [new file with mode: 0644]
source/unres/src-HCD-5D/minimize_p.F
source/unres/src-HCD-5D/readpdb-mult.F [new file with mode: 0644]
source/unres/src-HCD-5D/readpdb.F
source/unres/src-HCD-5D/readrtns_CSA.F
source/unres/src-HCD-5D/rmscalc.F
source/unres/src-HCD-5D/sc_move.F
source/unres/src-HCD-5D/stochfric.F
source/unres/src-HCD-5D/unres.F
source/wham/src-HCD-5D/Makefile_MPICH_ifort-okeanos
source/wham/src-HCD-5D/readpdb.F