PBC working for EGB (only)
authorAdam Sieradzan <adasko@piasek4.chem.univ.gda.pl>
Tue, 25 Apr 2017 12:06:30 +0000 (14:06 +0200)
committerAdam Sieradzan <adasko@piasek4.chem.univ.gda.pl>
Tue, 25 Apr 2017 12:06:30 +0000 (14:06 +0200)
commitc43a5a1d5cc1d3f94c53de28dd1fd93bea770790
tree9d18ea51cb8a6674bf3e1e1077cdcf8c59e627c3
parent5caab5415c9f7622a0d0085135a520b49f5cd4fd
PBC working for EGB (only)
12 files changed:
.gitignore
PARAM/bond_AM1_ext_dum.parm [new file with mode: 0644]
source/unres/MCM_MD.f90
source/unres/data/control_data.f90
source/unres/data/energy_data.f90
source/unres/data/geometry_data.f90
source/unres/energy.f90
source/unres/geometry.f90
source/unres/io_config.f90
source/unres/minim.f90
source/unres/regularize.f90
source/unres/unres.f90