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saxs and adam's corrections to multichain
[unres.git]
/
source
/
wham
/
src-M
/
readrtns.F
diff --git
a/source/wham/src-M/readrtns.F
b/source/wham/src-M/readrtns.F
index
271fca8
..
51216d9
100644
(file)
--- a/
source/wham/src-M/readrtns.F
+++ b/
source/wham/src-M/readrtns.F
@@
-126,6
+126,10
@@
C endif
refstr = index(controlcard,'REFSTR').gt.0
pdbref = index(controlcard,'PDBREF').gt.0
dyn_ss=(index(controlcard,'DYN_SS').gt.0)
refstr = index(controlcard,'REFSTR').gt.0
pdbref = index(controlcard,'PDBREF').gt.0
dyn_ss=(index(controlcard,'DYN_SS').gt.0)
+ call readi(controlcard,'NSAXS',nsaxs,0)
+ call readi(controlcard,'SAXS_MODE',saxs_mode,0)
+ write (iout,*) "Number of SAXS restraints",NSAXS," SAXS_MODE",
+ & SAXS_MODE
C /06/28/2013 Adasko: dyn_ss is keyword allowing to break and create bond
C disulfide bond. Note that in conterary to dynamics this in
C CONTROLCARD. The bond are read in molread_zs.F
C /06/28/2013 Adasko: dyn_ss is keyword allowing to break and create bond
C disulfide bond. Note that in conterary to dynamics this in
C CONTROLCARD. The bond are read in molread_zs.F