introduction of infinite cylinder potential - currently without PBC
authorAdam Sieradzan <adasko@piasek4.chem.univ.gda.pl>
Wed, 30 Mar 2016 20:43:39 +0000 (22:43 +0200)
committerAdam Sieradzan <adasko@piasek4.chem.univ.gda.pl>
Wed, 30 Mar 2016 20:43:39 +0000 (22:43 +0200)
commitc1827efa66e69c93c6e2b2e7420b06b430c3550a
tree42f3512e728c966cefc4690512fb554454542c9d
parent9ab6a6c94ffa93357b777d7a01615bc2cb964622
introduction of infinite cylinder potential - currently without PBC
12 files changed:
PARAM/tube.parm [new file with mode: 0644]
source/unres/src_MD-M/COMMON.CHAIN
source/unres/src_MD-M/COMMON.CONTROL
source/unres/src_MD-M/COMMON.DERIV
source/unres/src_MD-M/COMMON.FFIELD
source/unres/src_MD-M/COMMON.INTERACT
source/unres/src_MD-M/COMMON.IOUNITS
source/unres/src_MD-M/energy_p_new_barrier.F
source/unres/src_MD-M/gradient_p.F
source/unres/src_MD-M/initialize_p.F
source/unres/src_MD-M/parmread.F
source/unres/src_MD-M/readrtns_CSA.F