average-minimum-distance
1.1.7
Common tasks
Reading .CIFs
Reading from the CSD
Using AMDs
Using PDDs
Write crystals and fingerprints to a file
Miscellaneous
Modules
amd.calculate module
amd.compare module
amd.io module
amd.periodicset module
amd.utils module
amd.ccdc_utils module
average-minimum-distance
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Index
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Index
A
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C
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D
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E
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F
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H
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I
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K
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M
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N
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P
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R
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S
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T
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U
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W
A
amd
module
AMD() (in module amd.calculate)
amd.calculate
module
amd.ccdc_utils
module
amd.compare
module
amd.io
module
amd.periodicset
module
amd.utils
module
AMD_cdist() (in module amd.compare)
AMD_estimate() (in module amd.calculate)
AMD_mst() (in module amd.compare)
AMD_pdist() (in module amd.compare)
astype() (amd.periodicset.PeriodicSet method)
C
cell_str_as_html() (in module amd.ccdc_utils)
cellpar_to_cell() (in module amd.utils)
cellpar_to_cell_2D() (in module amd.utils)
chemical_name() (in module amd.ccdc_utils)
chemical_name_as_html() (in module amd.ccdc_utils)
cifblock_to_periodicset() (in module amd.io)
CifReader (class in amd.io)
close() (amd.io.SetReader method)
(amd.io.SetWriter method)
crystal_system() (in module amd.ccdc_utils)
crystal_to_periodicset() (in module amd.io)
CSDReader (class in amd.io)
D
density() (in module amd.ccdc_utils)
E
emd() (in module amd.compare)
entry() (amd.io.CSDReader method)
ETA (class in amd.utils)
extract_tags() (amd.io.SetReader method)
(in module amd.utils)
F
family() (amd.io.SetReader method)
filter() (in module amd.compare)
finite_AMD() (in module amd.calculate)
finite_PDD() (in module amd.calculate)
formula() (in module amd.ccdc_utils)
H
has_disorder() (in module amd.ccdc_utils)
I
is_organic() (in module amd.ccdc_utils)
iwrite() (amd.io.SetWriter method)
K
keys() (amd.io.SetReader method)
M
module
amd
amd.calculate
amd.ccdc_utils
amd.compare
amd.io
amd.periodicset
amd.utils
molecular_centres() (in module amd.ccdc_utils)
mst_from_distance_matrix() (in module amd.compare)
N
neighbours_df_dict() (in module amd.utils)
neighbours_from_distance_matrix() (in module amd.compare)
P
PDD() (in module amd.calculate)
PDD_cdist() (in module amd.compare)
PDD_mst() (in module amd.compare)
PDD_pdist() (in module amd.compare)
PDD_to_AMD() (in module amd.calculate)
PeriodicSet (class in amd.periodicset)
polymorph() (in module amd.ccdc_utils)
PPC() (in module amd.calculate)
R
random_cell() (in module amd.utils)
refcode_family() (in module amd.ccdc_utils)
S
SetReader (class in amd.io)
SetWriter (class in amd.io)
spacegroup() (in module amd.ccdc_utils)
T
to_dict() (amd.periodicset.PeriodicSet method)
U
update() (amd.utils.ETA method)
W
write() (amd.io.SetWriter method)
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v: 1.1.7
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