X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Fwham%2Fsrc-restraints-DFA%2Fenergy_p_new.F;h=a9cbc0ec24503e338f1bf42c58ee18ed0146b265;hb=a09fdb5f3686a0c1242c8dd3b6dfadf0d3678aaf;hp=e9d735cd2a00a10f7c5abfad285f780084dcc398;hpb=5467f8060e885151d3415a9897913776c337d88a;p=unres.git diff --git a/source/wham/src-restraints-DFA/energy_p_new.F b/source/wham/src-restraints-DFA/energy_p_new.F index e9d735c..a9cbc0e 100644 --- a/source/wham/src-restraints-DFA/energy_p_new.F +++ b/source/wham/src-restraints-DFA/energy_p_new.F @@ -116,13 +116,13 @@ c write(iout,*) "TEST_ENE1 ehomology_constr=",ehomology_constr C BARTEK for dfa test! if (wdfa_dist.gt.0) call edfad(edfadis) -c write(iout,*)'edfad is finished!', wdfa_dist,edfadis + write(iout,*)'edfad is finished!', wdfa_dist,edfadis if (wdfa_tor.gt.0) call edfat(edfator) -c write(iout,*)'edfat is finished!', wdfa_tor,edfator + write(iout,*)'edfat is finished!', wdfa_tor,edfator if (wdfa_nei.gt.0) call edfan(edfanei) -c write(iout,*)'edfan is finished!', wdfa_nei,edfanei + write(iout,*)'edfan is finished!', wdfa_nei,edfanei if (wdfa_beta.gt.0) call edfab(edfabet) -c write(iout,*)'edfab is finished!', wdfa_beta,edfabet + write(iout,*)'edfab is finished!', wdfa_beta,edfabet c write (iout,*) "ft(6)",fact(6)," evdw",evdw," evdw_t",evdw_t #ifdef SPLITELE