pyCSRML
User guide
Installation
Quick start
Timing Benchmarks
CSRML format
Custom fingerprints: JSON and YAML format
API reference
Fingerprinter API
CSRML parser API
About
Changelog
pyCSRML
Index
Index
B
|
F
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M
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N
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O
|
P
|
T
B
bit_ids (pyCSRML.fingerprinter.Fingerprinter property)
bit_names (pyCSRML.fingerprinter.Fingerprinter property)
F
fingerprint() (pyCSRML.fingerprinter.Fingerprinter method)
fingerprint_batch() (pyCSRML.fingerprinter.Fingerprinter method)
fingerprint_smiles() (pyCSRML.fingerprinter.Fingerprinter method)
Fingerprinter (class in pyCSRML.fingerprinter)
M
module
pyCSRML._csrml
pyCSRML.fingerprinter
N
n_bits (pyCSRML.fingerprinter.Fingerprinter property)
O
ordered_bit_list() (in module pyCSRML._csrml)
P
parse_csrml_xml() (in module pyCSRML._csrml)
pyCSRML._csrml
module
pyCSRML.fingerprinter
module
T
title (pyCSRML.fingerprinter.Fingerprinter property)
TOXPRINT_PATH (in module pyCSRML.fingerprinter)
TXPPFAS_PATH (in module pyCSRML.fingerprinter)