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more xdrfpdb fixes for gfortran build
author
Dawid Jagiela
<lightnir@chem.univ.gda.pl>
Tue, 22 May 2012 21:06:12 +0000
(23:06 +0200)
committer
Dawid Jagiela
<lightnir@chem.univ.gda.pl>
Tue, 22 May 2012 21:06:12 +0000
(23:06 +0200)
source/xdrfpdb/src-M/xdrf2pdb-m.F
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source/xdrfpdb/src/xdrf2ang.f
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source/xdrfpdb/src/xdrf2pdb-m.F
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source/xdrfpdb/src/xdrf2x.F
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diff --git
a/source/xdrfpdb/src-M/xdrf2pdb-m.F
b/source/xdrfpdb/src-M/xdrf2pdb-m.F
index
0016d40
..
b665b89
100644
(file)
--- a/
source/xdrfpdb/src-M/xdrf2pdb-m.F
+++ b/
source/xdrfpdb/src-M/xdrf2pdb-m.F
@@
-39,7
+39,8
@@
10 continue
nres=i
i=0
10 continue
nres=i
i=0
- do while (.not.iblnk(sequenc(i+1)(1:1)))
+c do while (.not.iblnk(sequenc(i+1)(1:1)))
+ do while (.not.(iblnk(sequenc(i+1)(1:1))==0) )
i=i+1
enddo
nres=i
i=i+1
enddo
nres=i
@@
-51,7
+52,8
@@
11 continue
nres=i
i=0
11 continue
nres=i
i=0
- do while (.not.iblnk(sequenc(i+1)(1:1)))
+c do while (.not.iblnk(sequenc(i+1)(1:1)))
+ do while (.not.(iblnk(sequenc(i+1)(1:1))==0))
i=i+1
enddo
nres=i
i=i+1
enddo
nres=i
diff --git
a/source/xdrfpdb/src/xdrf2ang.f
b/source/xdrfpdb/src/xdrf2ang.f
index
83daf77
..
dbd5852
100644
(file)
--- a/
source/xdrfpdb/src/xdrf2ang.f
+++ b/
source/xdrfpdb/src/xdrf2ang.f
@@
-47,7
+47,8
@@
10 continue
nres=i
i=0
10 continue
nres=i
i=0
- do while (.not.iblnk(sequenc(i+1)(1:1)))
+c do while (.not.iblnk(sequenc(i+1)(1:1)))
+ do while (.not.(iblnk(sequenc(i+1)(1:1)) == 0) )
i=i+1
enddo
nres=i
i=i+1
enddo
nres=i
diff --git
a/source/xdrfpdb/src/xdrf2pdb-m.F
b/source/xdrfpdb/src/xdrf2pdb-m.F
index
6a116ee
..
f929efe
100644
(file)
--- a/
source/xdrfpdb/src/xdrf2pdb-m.F
+++ b/
source/xdrfpdb/src/xdrf2pdb-m.F
@@
-39,7
+39,8
@@
10 continue
nres=i
i=0
10 continue
nres=i
i=0
- do while (.not.iblnk(sequenc(i+1)(1:1)))
+c do while (.not.iblnk(sequenc(i+1)(1:1)))
+ do while (.not.(iblnk(sequenc(i+1)(1:1)) == 0))
i=i+1
enddo
nres=i
i=i+1
enddo
nres=i
@@
-51,7
+52,8
@@
11 continue
nres=i
i=0
11 continue
nres=i
i=0
- do while (.not.iblnk(sequenc(i+1)(1:1)))
+c do while (.not.iblnk(sequenc(i+1)(1:1)))
+ do while (.not.(iblnk(sequenc(i+1)(1:1)) == 0))
i=i+1
enddo
nres=i
i=i+1
enddo
nres=i
diff --git
a/source/xdrfpdb/src/xdrf2x.F
b/source/xdrfpdb/src/xdrf2x.F
index
b6e86cf
..
be662e6
100644
(file)
--- a/
source/xdrfpdb/src/xdrf2x.F
+++ b/
source/xdrfpdb/src/xdrf2x.F
@@
-3,7
+3,8
@@
integer ihpb(100),jhpb(100)
character*80 arg,ctime_start /"0"/,ctime_end /"1000000000"/,
& cfreq /"1"/
integer ihpb(100),jhpb(100)
character*80 arg,ctime_start /"0"/,ctime_end /"1000000000"/,
& cfreq /"1"/
- integer time_start,time_end,freq
+c integer time_start,time_end,freq
+ real time_start,time_end,freq
call getarg(1,arg)
if (iargc().eq.0) stop
call getarg(1,arg)
if (iargc().eq.0) stop