added NEWCORR5D
authorAdam Sieradzan <adasko@piasek4.chem.univ.gda.pl>
Wed, 8 Mar 2023 10:14:49 +0000 (11:14 +0100)
committerAdam Sieradzan <adasko@piasek4.chem.univ.gda.pl>
Wed, 8 Mar 2023 10:14:49 +0000 (11:14 +0100)
commitc2b8cd6399133f378681275a7498952235472c0a
tree4267ba2d2afdad0f4e13865ccca509c65ad1a244
parent545cf9507d923cdf917d80ed079c753702c68840
added NEWCORR5D
15 files changed:
PARAM/nmr.parm
PARAM/omicron_AM1.parm-04 [new file with mode: 0644]
source/unres/CMakeLists.txt
source/unres/MD.F90
source/unres/REMD.F90
source/unres/control.F90
source/unres/data/MD_data.F90
source/unres/data/energy_data.F90
source/unres/data/geometry_data.F90
source/unres/data/io_units.F90
source/unres/energy.F90
source/unres/io.F90
source/unres/io_base.F90
source/unres/io_config.F90
source/unres/unres.F90