X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=PARAM%2Ffourier_opt_ext.parm.1igd_hc_iter3_3;fp=PARAM%2Ffourier_opt_ext.parm.1igd_hc_iter3_3;h=433e995e20305c143ae7ef61a5d622f2e926a3ee;hb=7fcc0efe632e299b8b944facdca6b9320c8c78da;hp=0000000000000000000000000000000000000000;hpb=05283f438be84bc574c0d6aad77f39de1303d679;p=unres.git diff --git a/PARAM/fourier_opt_ext.parm.1igd_hc_iter3_3 b/PARAM/fourier_opt_ext.parm.1igd_hc_iter3_3 new file mode 100644 index 0000000..433e995 --- /dev/null +++ b/PARAM/fourier_opt_ext.parm.1igd_hc_iter3_3 @@ -0,0 +1,43 @@ + 3 # Number of local interaction types +Gly + 0.000000000000000 + 0.791965124028570 + 0.206068961118571 + 0.000000000000000 + 0.000000000000000 + 2.373462483972307 + -0.927962753087420 + 0.000000000000000 + 0.000000000000000 + 1.329421814829764 + -0.370576187607876 + 0.000000000000000 + 0.000000000000000 +Ala + 0.000000000000000 + 0.500261572719827 + -0.233786079150650 + -0.878020534542259 + 1.501220349138902 + -2.089734050079038 + 2.302365702770721 + -0.532502145482045 + -1.596421505165690 + 1.276301651241011 + 0.399942874780603 + -0.543778421330412 + 0.400478498916355 +Pro + 0.000000000000000 + -1.286480000000000 + 0.031808800000000 + -0.906628000000000 + 1.015390000000000 + -1.548870000000000 + 1.914370000000000 + 0.664143000000000 + -0.454839000000000 + -0.051291400000000 + 0.103179000000000 + 0.316367000000000 + 0.045277200000000