X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Fcluster%2Fwham%2Fsrc%2Fwrtclust.f;h=6012b05ddb3e8bfcc23082f3b2ee45daf11747ed;hb=64b0c5822d976031125efd68857ec66056ff4a0e;hp=8303f0c0b6c073bf8a8368382fd0adda488bf067;hpb=9eac8e3582cd09922d0d2c4142adcb85232e9c77;p=unres.git diff --git a/source/cluster/wham/src/wrtclust.f b/source/cluster/wham/src/wrtclust.f index 8303f0c..6012b05 100644 --- a/source/cluster/wham/src/wrtclust.f +++ b/source/cluster/wham/src/wrtclust.f @@ -263,9 +263,9 @@ c create InsightII command file for their displaying in different colors 200 FORMAT (/'FAMILY ',I4,' WITH TOTAL FREE ENERGY',1pE15.5, & ' CONTAINS ',I4,' CONFORMATION(S): ') c 300 FORMAT ( 8(I4,F6.1)) - 300 FORMAT (5(I4,1pe12.3)) + 300 FORMAT (5(I6,1pe12.3)) 400 FORMAT (//'ASSIGNMENT OF CONSECUTIVE CONFORMATIONS TO FAMILIES:') - 500 FORMAT (8(2I4,2X)) + 500 FORMAT (8(I6,I4,2X)) 600 FORMAT ('REMARK FAMILY',I4,' CONFORMATION',I4,' ENERGY ',E15.6) RETURN END