Fixed the homology gradient in finegrain mode
authorAdam Liwo <adam@piasek4.chem.univ.gda.pl>
Fri, 12 Jun 2015 14:23:42 +0000 (16:23 +0200)
committerAdam Liwo <adam@piasek4.chem.univ.gda.pl>
Fri, 12 Jun 2015 14:23:42 +0000 (16:23 +0200)
commitaa4540154949fdfc9ab63442eb6fea09d6c589ad
treead83087946663edf6c25659477ed19d1fb25fb48
parentdb56b439e1060711e4960527aa97d0c10f488715
Fixed the homology gradient in finegrain mode
source/unres/src_MD/Makefile_MPICH_ifort
source/unres/src_MD/energy_p_new_barrier.F
source/unres/src_MD/gradient_p.F
source/wham/src/enecalc1.F