From: Aleksei Iupinov Date: Thu, 8 Feb 2018 10:47:06 +0000 (+0100) Subject: Merge branch 'release-2018' into master X-Git-Url: http://biod.pnpi.spb.ru/gitweb/?a=commitdiff_plain;h=c3ab8222330d5f2bc47fa42cbf3e74965d8eed1b;p=alexxy%2Fgromacs.git Merge branch 'release-2018' into master Manually modified: src/programs/mdrun/md.cpp (to uncomment done_ebin()) Change-Id: Ic3887c40668f69e69ee8da15d210721b8bd3e95f --- c3ab8222330d5f2bc47fa42cbf3e74965d8eed1b diff --cc src/programs/mdrun/md.cpp index bda2386e9b,a4d07c9167..add6985075 --- a/src/programs/mdrun/md.cpp +++ b/src/programs/mdrun/md.cpp @@@ -1984,7 -1991,8 +1984,7 @@@ double gmx::do_md(FILE *fplog, t_commre eprAVER, mdebin, fcd, groups, &(ir->opts), ir->awh); } } - - // TODO Enable the next line when merging to master branch - // done_ebin(mdebin->ebin); ++ done_ebin(mdebin->ebin); done_mdoutf(outf); if (bPMETune)