From: Cezary Czaplewski Date: Tue, 26 Sep 2017 18:24:47 +0000 (+0200) Subject: gfortran errors X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=commitdiff_plain;h=6ac7aa57d0bfb064199114f14235b334c9389242;p=unres.git gfortran errors --- diff --git a/source/cluster/wham/src-M/initialize_p.F b/source/cluster/wham/src-M/initialize_p.F index d234763..40d035c 100644 --- a/source/cluster/wham/src-M/initialize_p.F +++ b/source/cluster/wham/src-M/initialize_p.F @@ -260,12 +260,12 @@ c------------------------------------------------------------------------- & "ECORR6 ","EELLO ","ETURN3 ","ETURN4 ","ETURN6 ", & "EBE bend","ESC SCloc","ETORS ","ETORSD ","EHPB","EVDWPP", & "EVDW2_14","ESTR","ESCCOR","EDIHC","EVDW_T","ELIPTRAN", - & "EAFM","ETHETC"/ + & "EAFM","ETHETC",""/ data wname / & "WSC","WSCP","WELEC","WCORR","WCORR5","WCORR6","WEL_LOC", & "WTURN3","WTURN4","WTURN6","WANG","WSCLOC","WTOR","WTORD", & "WHPB","WVDWPP","WSCP14","WBOND","WSCCOR","WDIHC","WSC", - & "WLIPTRAN","WAFM","WTHETC"/ + & "WLIPTRAN","WAFM","WTHETC",""/ data nprint_ene /22/ data print_order /1,2,3,18,11,12,13,14,4,5,6,7,8,9,10,19, & 16,15,17,20,21,24,22,23,0/ diff --git a/source/cluster/wham/src-M/ssMD.F b/source/cluster/wham/src-M/ssMD.F index 42983f8..1fd3325 100644 --- a/source/cluster/wham/src-M/ssMD.F +++ b/source/cluster/wham/src-M/ssMD.F @@ -126,6 +126,7 @@ c integer itypi,itypj,k,l double precision d_ssxm(1:3),d_ljxm(1:3),d_ssm(1:3),d_ljm(1:3) double precision f1,f2,h1,h2,hd1,hd2 double precision omega,delta_inv,deltasq_inv,fac1,fac2 + double precision xi,yi,zi c-------FIRST METHOD double precision xm,d_xm(1:3) c-------END FIRST METHOD