unres_package_Oct_2016 from emilial

[unres4.git] / source / unres / io_units.f90

diff --git a/source/unres/io_units.f90 b/source/unres/io_units.f90
deleted file mode 100644 (file)
index 9e96c0e..0000000
--- a/source/unres/io_units.f90
+++ /dev/null
@@ -1,63 +0,0 @@
-      module io_units
-!-----------------------------------------------------------------------
-! common.iounits
-! I/O units used by the program
-!-----------------------------------------------------------------------
-! 9/18/99 - unit ifourier and filename fouriername included to identify
-! the file from which the coefficients of second-order Fourier expansion
-! of the local-interaction energy are read.
-! 8/9/01 - file for SCP interaction constants named scpname (unit iscpp)
-! included.
-!-----------------------------------------------------------------------
-! General I/O units & files
-!      common /iounits/
-      integer :: inp,iout,igeom,intin,ipdb,imol2,ipdbin,ithep,irotam,&
-       itorp,itordp,ifourier,ielep,isidep,iscpp,icbase,istat,ientin,&
-       ientout,izs1,isecpred,ibond,irest2,iifrag,icart,irest1,isccor,&
-       ithep_pdb,irotam_pdb
-#ifdef WHAM_RUN
-! el wham iounits
-      integer :: isidep1,ihist,iweight,izsc,idistr
-#endif
-!      common /fnames/
-      character(len=256) :: outname,intname,pdbname,mol2name,statname,&
-       intinname,entname,prefix,secpred,rest2name,qname,cartname,&
-       tmpdir,mremd_rst_name,curdir,pref_orig
-
-!#ifdef WHAM_RUN
-! el wham iounits
-      character(len=256) :: restartnam,scratchdir,sidepname,pdbfile,&
-                            histname,zscname
-      character(len=4) :: liczba
-      character(len=3) :: pot
-!#endif
-! Parameter files
-!      common /parfiles/
-      character(len=256) :: bondname,thetname,rotname,torname,tordname,&
-       fouriername,elename,sidename,scpname,sccorname,patname,&
-       thetname_pdb,rotname_pdb
-!-----------------------------------------------------------------------
-! INP    - main input file
-! IOUT   - list file
-! IGEOM  - geometry output in the form of virtual-chain internal coordinates
-! INTIN  - geometry input (for multiple conformation processing) in int. coords.
-! IPDB   - Cartesian-coordinate output in PDB format
-! IMOL2  - Cartesian-coordinate output in Tripos mol2 format
-! IPDBIN - PDB input file
-! ITHEP  - virtual-bond torsional angle parametrs
-! IROTAM - side-chain geometry and local-interaction parameters
-! ITORP  - torsional parameters
-! ITORDP  - double torsional parameters
-! IFOURIER - coefficients of the expansion of local-interaction energy 
-! IELEP  - electrostatic-interaction parameters
-! ISIDEP - side-chain interaction parameters.
-! ISCPP  - SCp interaction parameters.
-! IBOND  - virtual-bond constant parameters and moments of inertia.
-! ISCCOR - parameters of the potential of SCCOR term
-! ICBASE - data base with Cartesian coords of known structures.
-! ISTAT  - energies and other conf. characteristics from an MCM run.
-! IENTIN - entropy from preceeding simulation(s) to be read in.
-! SECPRED - SECONDARY STRUCTURE PREDICTION for dihedral constraint generation.
-!-----------------------------------------------------------------------------
-!-----------------------------------------------------------------------------
-      end module io_units