update new files
[unres.git] / source / unres / src_MD-M-SAXS / COMMON.CONTROL
1       integer modecalc,iscode,indpdb,indback,indphi,iranconf,icheckgrad,
2      & inprint,i2ndstr,mucadyn,constr_dist,symetr,AFMlog,selfguide,
3      & shield_mode,tor_mode,tubelog,nsaxs,saxs_mode,iprint
4       logical minim,refstr,pdbref,outpdb,outmol2,overlapsc,energy_dec,
5      &                 mremd_dec,sideadd,lsecondary,read_cart,unres_pdb,
6      &                 vdisulf,searchsc,lmuca,dccart,extconf,out1file,
7      & gnorm_check,gradout,split_ene,with_theta_constr,with_dihed_constr
8       real*8 Psaxs(maxsaxs),distsaxs(maxsaxs),CSAXS(3,maxsaxs),wsaxs0,
9      & scal_rad, saxs_cutoff
10       double precision aincr
11       common /cntrl/ aincr,modecalc,iscode,indpdb,indback,indphi,
12      & iranconf,
13      & icheckgrad,minim,i2ndstr,refstr,pdbref,outpdb,outmol2,iprint,
14      & overlapsc,energy_dec,mremd_dec,sideadd,lsecondary,read_cart,
15      & unres_pdb,vdisulf,searchsc,lmuca,dccart,mucadyn,extconf,out1file,
16      & selfguide,AFMlog,shield_mode,tor_mode,tubelog,
17      & constr_dist,gnorm_check,gradout,split_ene,with_theta_constr,
18      & with_dihed_constr,symetr
19       common /saxsretr/Psaxs,distsaxs,csaxs,Wsaxs0,scal_rad,saxs_cutoff,
20      & nsaxs,saxs_mode
21 C... minim = .true. means DO minimization.
22 C... energy_dec = .true. means print energy decomposition matrix