X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Fwham%2Fsrc%2Fparmread.F;h=abb33a097ce578fd2a2dc12ad2d0e2dde89c8534;hb=aa037b39c46474f358b050551261d7c5ac3d2357;hp=435ee09bdb56b87d5f136adeb08959265cbaeac2;hpb=1a8216297db4d3568d41817711f75f97881e4569;p=unres.git diff --git a/source/wham/src/parmread.F b/source/wham/src/parmread.F index 435ee09..abb33a0 100644 --- a/source/wham/src/parmread.F +++ b/source/wham/src/parmread.F @@ -99,6 +99,12 @@ c wstrain=ww(15) wbond=ww(18) wsccor=ww(19) + wdfa_dist=ww(23) + wdfa_tor=ww(24) + wdfa_nei=ww(25) + wdfa_beta=ww(26) + write (iout,*) "wdfa_dist",wdfa_dist," wdfa_tor",wdfa_tor, + & " wdfa_nei",wdfa_nei," wdfa_beta",wdfa_beta endif cc write(iout,*) "KURWA", wstrain,akcm,akth,wsc,dyn_ss @@ -641,6 +647,7 @@ cc maxinter is maximum interaction sites if (lprint) then write (iout,'(/a/)') 'Torsional constants:' + do l=1,maxinter do i=1,nsccortyp do j=1,nsccortyp write (iout,*) 'ityp',i,' jtyp',j @@ -655,6 +662,7 @@ cc maxinter is maximum interaction sites enddo enddo enddo + enddo endif C