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 BIOVIA, San Diego 2007
 LibDock version: 2.3
 Build date: Oct 14 2018

 D. Diller & K. Merz (2001).
 "High Throughput Docking for Library Design and Library Prioritization."
 Proteins: Struct., Funct., and Genet. 43:113-124.

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####################### PARAMETER VALUES ###########################
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#  XLO                                -26.74
#  YLO                                -3.02
#  ZLO                                -24.83
#  XHI                                -7.27
#  YHI                                16.46
#  ZHI                                -5.35
#  NUM_HOT_SPOTS                      100
#  PROTEIN_PDB                        3GEN.pdb
#  HS_FILE                            Hotspots-3GEN.pdb
#  HOST_NAME                          AbdusemiAbduweli
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##################### END OF PARAMETER VALUES ######################
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Checked out license feature: DS_LibDock <v2009.03> [for msi<TeAM SolidSQUAD-SSQ>] (1 copy)

There are 4350 atoms in 3GEN.pdb
The volume of the binding site is 547.87
There were 67581 points below the cutoff
The expected value is -3.67
The std= 1.56
There are 11617 points above 1 sigma
There are 2585 points above 2 sigma
There are 36 points above 3 sigma
There are 0 points above 4 sigma
There are 0 points above 5 sigma
The Apolar grid
There are 100 apolar clusters
The Polar grid
There were 68442 points below the cutoff
The expected value is -3.24
The std= 2.43
There are 10143 points above 1 sigma
There are 3532 points above 2 sigma
There are 816 points above 3 sigma
There are 55 points above 4 sigma
There are 0 points above 5 sigma
There are 100 polar clusters

CPU time: 3.87[s]

Released LibDock License