X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Fwham%2Fsrc-NEWSC%2Frescode.f;fp=source%2Fwham%2Fsrc-NEWSC%2Frescode.f;h=b516fedf505bd03f9e3517968e0074bae5f70b7e;hb=7308760ff07636ef6b1ee28d8c3a67a23c14b34b;hp=0000000000000000000000000000000000000000;hpb=9a54ab407f6d0d9d564d52763b3e2136450b9ffc;p=unres.git

diff --git a/source/wham/src-NEWSC/rescode.f b/source/wham/src-NEWSC/rescode.f
new file mode 100755
index 0000000..b516fed
--- /dev/null
+++ b/source/wham/src-NEWSC/rescode.f
@@ -0,0 +1,32 @@
+      integer function rescode(iseq,nam,itype)
+      include 'DIMENSIONS'
+      include 'DIMENSIONS.ZSCOPT'
+      include 'COMMON.NAMES'
+      include 'COMMON.IOUNITS'
+      character*3 nam,ucase
+
+      if (itype.eq.0) then
+
+      do i=1,ntyp1
+        if (ucase(nam).eq.restyp(i)) then
+          rescode=i
+          return
+        endif
+      enddo
+
+      else
+
+      do i=1,ntyp1
+        if (nam(1:1).eq.onelet(i)) then
+          rescode=i
+          return  
+        endif  
+      enddo
+
+      endif
+
+      write (iout,10) iseq,nam
+      stop
+   10 format ('**** Error - residue',i4,' has an unresolved name ',a3)
+      end
+