Package AutoDockTools :: Package Utilities24 :: Module write_all_complexes

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Module write_all_complexes

source code

Functions

[hide private]

usage()
Print helpful, accurate usage statement to stdout.

Variables

[hide private]

docking_filename = None

receptor_filename = None

write_best_only = False

verbose = False

d = Docking()

receptor_stem = os.path.splitext(os.path.basename(receptor_filename)...

rptr = open(receptor_filename)

receptor_lines = rptr.readlines()

rms = d.clusterer.clustering_dict.keys() [0]

confs = d.ch.conformations

output_stem = receptor_stem+ '_'+ d.ligMol.name

Function Details

[hide private]

usage()

source code

Print helpful, accurate usage statement to stdout.

Variables Details

[hide private]

docking_filename

None

Value:

None

receptor_filename

None

Value:

None

write_best_only

None

Value:

False

verbose

None

Value:

False

d

None

Value:

Docking()

receptor_stem

None

Value:

os.path.splitext(os.path.basename(receptor_filename)) [0]

rptr

None

Value:

open(receptor_filename)

receptor_lines

None

Value:

rptr.readlines()

rms

None

Value:

d.clusterer.clustering_dict.keys() [0]

confs

None

Value:

d.ch.conformations

output_stem

None

Value:

receptor_stem+ '_'+ d.ligMol.name