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Adam's 5D respa
[unres.git]
/
source
/
unres
/
src-HCD-5D
/
COMMON.INTERACT
diff --git
a/source/unres/src-HCD-5D/COMMON.INTERACT
b/source/unres/src-HCD-5D/COMMON.INTERACT
index
3440239
..
6db43d0
100644
(file)
--- a/
source/unres/src-HCD-5D/COMMON.INTERACT
+++ b/
source/unres/src-HCD-5D/COMMON.INTERACT
@@
-24,12
+24,15
@@
C 3/26/20 Interaction lists
integer newcontlisti(200*maxres),newcontlistj(200*maxres),
& newcontlistppi(200*maxres),newcontlistppj(200*maxres),
C 3/26/20 Interaction lists
integer newcontlisti(200*maxres),newcontlistj(200*maxres),
& newcontlistppi(200*maxres),newcontlistppj(200*maxres),
+ & newcontlistpp_vdwi(200*maxres),newcontlistpp_vdwj(200*maxres),
& newcontlistscpi(200*maxres),newcontlistscpj(200*maxres),
& g_listscsc_start,g_listscsc_end,g_listpp_start,g_listpp_end,
& newcontlistscpi(200*maxres),newcontlistscpj(200*maxres),
& g_listscsc_start,g_listscsc_end,g_listpp_start,g_listpp_end,
- & g_listscp_start,g_listscp_end
+ & g_listpp_vdw_start,g_listpp_vdw_end,g_listscp_start,g_listscp_end
common /interact_list/newcontlisti,newcontlistj,g_listscsc_start,
& g_listscsc_end,newcontlistppi,newcontlistppj,g_listpp_start,
common /interact_list/newcontlisti,newcontlistj,g_listscsc_start,
& g_listscsc_end,newcontlistppi,newcontlistppj,g_listpp_start,
- & g_listpp_end,newcontlistscpi,newcontlistscpj,g_listscp_start,
+ & g_listpp_end,newcontlistpp_vdwi,newcontlistpp_vdwj,
+ & g_listpp_vdw_start,g_listpp_vdw_end,
+ & newcontlistscpi,newcontlistscpj,g_listscp_start,
& g_listscp_end
C 12/1/95 Array EPS included in the COMMON block.
double precision eps,epslip,sigma,sigmaii,rs0,chi,chip,alp,
& g_listscp_end
C 12/1/95 Array EPS included in the COMMON block.
double precision eps,epslip,sigma,sigmaii,rs0,chi,chip,alp,