X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Funres%2Fsrc_Eshel%2Fcartprint.f;fp=source%2Funres%2Fsrc_Eshel%2Fcartprint.f;h=d79409ebec8536c716856209f009eeba9f9a7faa;hb=7308760ff07636ef6b1ee28d8c3a67a23c14b34b;hp=0000000000000000000000000000000000000000;hpb=9a54ab407f6d0d9d564d52763b3e2136450b9ffc;p=unres.git

diff --git a/source/unres/src_Eshel/cartprint.f b/source/unres/src_Eshel/cartprint.f
new file mode 100644
index 0000000..d79409e
--- /dev/null
+++ b/source/unres/src_Eshel/cartprint.f
@@ -0,0 +1,19 @@
+      subroutine cartprint
+      implicit real*8 (a-h,o-z)
+      include 'DIMENSIONS'
+      include 'COMMON.CHAIN'
+      include 'COMMON.INTERACT'
+      include 'COMMON.NAMES'
+      include 'COMMON.IOUNITS'
+      write (iout,100)
+      do i=1,nres
+        write (iout,110) restyp(itype(i)),i,c(1,i),c(2,i),
+     &    c(3,i),c(1,nres+i),c(2,nres+i),c(3,nres+i)
+      enddo
+  100 format (//'              alpha-carbon coordinates       ',
+     &          '     centroid coordinates'/
+     1          '       ', 6X,'X',11X,'Y',11X,'Z',
+     &                          10X,'X',11X,'Y',11X,'Z')
+  110 format (a,'(',i3,')',6f12.5)
+      return
+      end