Unnecessary object files removed
[unres.git] / examples / unres / MD / ff_gab / unres_single.sh
1 #!/bin/sh
2 export POT=$1
3 export PREFIX=$2
4 #-----------------------------------------------------------------------------
5 #UNRES_BIN=../../bin/unres_MD_Tc-pgf90-single.exe
6 UNRES_BIN=../../bin/unres_MD_Tc-g77-single.exe
7 #-----------------------------------------------------------------------------
8 DD=../../PARAM
9 export BONDPAR=$DD/bond.parm
10 export THETPAR=$DD/thetaml.5parm
11 export ROTPAR=$DD/scgauss.parm
12 export TORPAR=$DD/torsion_631Gdp.parm
13 export TORDPAR=$DD/torsion_double_631Gdp.parm
14 export ELEPAR=$DD/electr_631Gdp.parm
15 export SIDEPAR=$DD/sc_GB_opt.1gab_3S_qclass5no310-shan2-sc-16-10-8k
16 export FOURIER=$DD/fourier_opt.parm.1igd_hc_iter3_3
17 export SCPPAR=$DD/scp.parm
18 export PATTERN=$DD/patterns.cart
19 #-----------------------------------------------------------------------------
20 $UNRES_BIN