energy of unres src_MD-M match prerelease
authorCezary Czaplewski <czarek@chem.univ.gda.pl>
Thu, 16 Feb 2017 08:41:06 +0000 (09:41 +0100)
committerCezary Czaplewski <czarek@chem.univ.gda.pl>
Thu, 16 Feb 2017 08:41:06 +0000 (09:41 +0100)
commit659f09e94bd1115ac6979ab4135480cc6c436954
treef216a59c76796f9331da91d229746072b12b98a5
parentc242d5fd98e6622cd7f73927506b9813876220b1
energy of unres src_MD-M match prerelease

wham and cluster must be changed asap
PARAM/fourier_opt_ext.parm.1igd_hc_iter3_3 [new file with mode: 0644]
PARAM/scinter_GB_ext_lip.parm [new file with mode: 0644]
PARAM/theta_abinitio_old_ext.parm
source/unres/src_MD-M/energy_p_new_barrier.F