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Wham po zmianach i dzialajac dla D aminokwasow i BEZ roznic energi ESTR.
[unres.git]
/
source
/
unres
/
src_MD-M
/
stochfric.F
diff --git
a/source/unres/src_MD-M/stochfric.F
b/source/unres/src_MD-M/stochfric.F
index
8faecc2
..
3ad7650
100644
(file)
--- a/
source/unres/src_MD-M/stochfric.F
+++ b/
source/unres/src_MD-M/stochfric.F
@@
-360,7
+360,7
@@
c Load the friction coefficients corresponding to side chains
ind=ind+1
ii = ind+m
iti=itype(i)
- gamvec(ii)=gamsc(iti)
+ gamvec(ii)=gamsc(iabs(iti))
enddo
if (surfarea) call sdarea(gamvec)
c if (lprn) then