Class GuruInterface

source code

   object --+        
            |        
EasyInterface --+    
                |    
  ExpertInterface --+
                    |
                   GuruInterface

Spyder-generated class

module haddock

file /home/sjoerd/Spyder-devel/haddock/haddock.spy

Description

Web form for the HADDOCK server Guru Interface

Wiki

http://www.spyderware.nl/wiki/classes/GuruInterface

Validate block

>>>            
if par_nonbonded != None: assert par_nonbonded in ("PROLSQ", "PARMALLH6", "PARALLHDG", "OPLSX")
if dielec != None: assert dielec in ("cdie", "rdie")
assert w_vdw == None or len(w_vdw) == 3
assert w_elec == None or len(w_elec) == 3
assert w_dist == None or len(w_dist) == 3
assert w_sani == None or len(w_sani) == 3
assert w_dani == None or len(w_dani) == 3
assert w_vean == None or len(w_vean) == 3
assert w_cdih == None or len(w_cdih) == 3
assert w_sym == None or len(w_sym) == 3
assert w_bsa == None or len(w_bsa) == 3
assert w_deint == None or len(w_deint) == 3
assert w_desolv == None or len(w_desolv) == 3
if firstwater != None: assert firstwater in ("yes", "no")
if solvate_method != None: assert solvate_method in ("db", "restraints", "pnt")
assert ncssegments == None or len(ncssegments) <= 5    
assert c2segments == None or len(c2segments) <= 10
assert c3segments == None or len(c3segments) <= 5
assert c4segments == None or len(c4segments) == 0
assert c5segments == None or len(c5segments) <= 1
assert auto_passive_radius >= 0 and auto_passive_radius <= 1000               
>>>

Form block

>>>            
OPTION par_nonbonded "PROLSQ", "PARMALLH6", "PARALLHDG", "OPLSX"
OPTION dielec "cdie", "rdie"
LENGTH w_vdw 3
LENGTH w_elec 3
LENGTH w_dist 3
LENGTH w_sani 3
LENGTH w_dani 3
LENGTH w_vean 3
LENGTH w_cdih 3
LENGTH w_sym 3
LENGTH w_bsa 3
LENGTH w_deint 3
LENGTH w_desolv 3
OPTION firstwater "yes", "no"
OPTION solvate_method "db", "restraints", "pnt"               
>>>

Converters

Can be converted to:

• ExpertInterface
  • CAST
• EasyInterface
  • CAST
• HaddockRunParameters
  • view converter (#1)

Can be converted from:

• ExpertInterface
  • CAST
• EasyInterface
  • CAST
• HaddockRunParameters
  • view converter (#2)