fix of malloc in xdrf2pdb-m
authorDawid Jagiela <lightnir@chem.univ.gda.pl>
Mon, 11 Jun 2012 12:02:09 +0000 (14:02 +0200)
committerDawid Jagiela <lightnir@chem.univ.gda.pl>
Mon, 11 Jun 2012 12:02:09 +0000 (14:02 +0200)
source/xdrfpdb/src/xdrf2pdb-m.F

index f929efe..ce89680 100644 (file)
@@ -12,7 +12,7 @@
       character*8 onethree,cfreq,cntraj,citraj
       character*8 ucase
       external ucase
-      logical oneletter
+      logical oneletter, iblnk
       integer rescode
       external rescode
       
@@ -39,8 +39,8 @@
    10   continue
         nres=i
         i=0
-c        do while (.not.iblnk(sequenc(i+1)(1:1)))
-        do while (.not.(iblnk(sequenc(i+1)(1:1)) == 0))
+        do while (.not.iblnk(sequenc(i+1)(1:1)))
+c        do while (.not.(iblnk(sequenc(i+1)(1:1)) == 0))
           i=i+1
         enddo 
         nres=i
@@ -52,8 +52,8 @@ c        do while (.not.iblnk(sequenc(i+1)(1:1)))
    11   continue
         nres=i
         i=0
-c        do while (.not.iblnk(sequenc(i+1)(1:1)))
-        do while (.not.(iblnk(sequenc(i+1)(1:1)) == 0))
+        do while (.not.iblnk(sequenc(i+1)(1:1)))
+c        do while (.not.(iblnk(sequenc(i+1)(1:1)) == 0))
           i=i+1
         enddo 
         nres=i