#Interface settings
#-pvmconf (Not set, no default)

#Omega :     
    -ewindow  15.000000
    -maxconfs 15000
    -maxpoolsize  40000
    -maxrot  40
    -maxtries  500000
    -minrigidfragment  6
    -ringlib ../../ringlib_no.txt
    -rms  0.3000
    -torlib ../../torlib_1205.txt
    # defaults torlib.1.8.b3.txt, data/torlib.1.8.b2.txt, torlib.txt do not differ
    # /raid1/people/jji/buildDB/files/torlib.feda.txt
    # /raid1/people/jji/buildDB/files/om18b/torlib.txt  ---> used+p-added


#Omicron :     
    -MMFF94s  false
    -itermax  1
    -keepconfs  1
    -numconfs  1
    -refine  false
    -tolerance  0.001000
    -truncmmff  false
    -verbose  false

#FileOptions :     
    -deleteallhydrogens  false
    -deletenonpolarhydrogens  false
    -fixcycle  true
    -fromCT  false
    -in  ../../../1_KEGG2SDF/TI_MOLS/
    -includeinput  false
    -interval  100
    -log  log
    -multioutputfiles  false
    -out ../../RING_ 
    -outputrigid  true
    -param  omega_phosphate_TI.param
    -prefix  omega
    -warts  false

#MMFF :     
    -constrain  -1.000000
    -finalcut  false
    -finalopt  false
    -finalscore  true
    -finalsheffield  false
    -initialopt  false

#PVM :     
    -pvmdebug  false
    -pvmpass  50