X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Fwham%2Fsrc-M%2Fpromienie.f;h=d04927d81f38fbdc29f504ecd03d3a83184c68e8;hb=7006db11d703450fb82ce20cfc53f74614334362;hp=12a2e8066f50ea55074abffd92f55a1edae174a0;hpb=478a9d9a1c99eb3f4bc4ca676ff3162bdd01d633;p=unres.git diff --git a/source/wham/src-M/promienie.f b/source/wham/src-M/promienie.f index 12a2e80..d04927d 100644 --- a/source/wham/src-M/promienie.f +++ b/source/wham/src-M/promienie.f @@ -1,6 +1,7 @@ subroutine promienie(*) implicit none include 'DIMENSIONS' + include 'DIMENSIONS.FREE' include 'COMMON.CONTROL' include 'COMMON.INTERACT' include 'COMMON.IOUNITS' @@ -36,7 +37,7 @@ enddo close (isidep1) do i=1,ntyp1 - if (i.eq.10 .or. i.eq.21) then + if (i.eq.10 .or. i.eq.ntyp1) then dsc_inv(i)=0.0d0 else dsc_inv(i)=1.0d0/dsc(i)