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D i L aminokwasy dzialajace dla src_MD
[unres.git]
/
source
/
unres
/
src_MD
/
gen_rand_conf.F
diff --git
a/source/unres/src_MD/gen_rand_conf.F
b/source/unres/src_MD/gen_rand_conf.F
index
ec15679
..
c751c3f
100644
(file)
--- a/
source/unres/src_MD/gen_rand_conf.F
+++ b/
source/unres/src_MD/gen_rand_conf.F
@@
-238,7
+238,8
@@
c print *,'gen_theta: it=',it
endif
thet_pred_mean=a0thet(it)
do k=1,2
- thet_pred_mean=thet_pred_mean+athet(k,it)*y(k)+bthet(k,it)*z(k)
+ thet_pred_mean=thet_pred_mean+athet(k,it,1,1)*y(k)
+ & +bthet(k,it,1,1)*z(k)
enddo
sig=polthet(3,it)
do j=2,0,-1