PyDigger - unearthing stuff about Python


NameVersionSummarydate
qsarKit 0.0.1 A Python package that offers robust predictive modeling using QSAR for evaluating the transfer of environmental contaminants in breast milk. It integrates multiple predictive models, provides synthetic data generation via GANs, and is tailored for researchers and health professionals. 2024-05-08 15:53:39
MolBokeh 1.0.1 Simple package to display molecules images in bokeh interactive charts. 2024-02-15 14:42:42
keyword-search 0.0.2 A keyword search for CSV/Excel/Pandas 2024-02-08 21:06:49
SpectraFP 1.2.3 A package to perform fingerprints from spectroscopy datas. 2024-02-01 23:30:07
pyADAqsar 1.1.1 A cheminformatics package to perform Applicability Domain of molecular fingerprints based in similarity calculation. 2024-01-17 13:20:12
CDK-pywrapper 0.1.0 Python wrapper for CDK molecular descriptors and fingerprints 2024-01-15 21:13:43
qsarify 0.1.1 QSARify: A tool for QSAR model development 2023-10-25 11:44:26
lazyqsar 0.3 A library to quickly build QSAR models 2023-09-25 12:02:22
jcompoundmapper-pywrapper 0.0.2 Python wrapper for jCompoundMapper molecular fingerprints 2023-08-23 12:52:15
Mold2-pywrapper 0.0.4 Python wrapper for Mold2 descriptors 2023-08-09 06:22:18
tacape 0.0.6 TACaPe: Transformed-based Anti-Cancer Peptide Classification and Generation 2023-07-28 18:19:09
PaDEL-pywrapper 1.0.4 Python wrapper for the PaDEL descriptors 2023-07-04 17:52:42
Signature-pywrapper 0.0.2.post1 Python wrapper for signature molecular descriptors 2023-07-04 17:38:45
BlueDesc 2008.10.3 BlueDesc - Molecular Descriptor Calculator 2023-06-26 21:01:59
papyrus-scripts 1.0.2 A collection of scripts to handle the Papyrus bioactivity dataset 2023-05-16 10:09:52
peptides 0.3.2 Physicochemical properties, indices and descriptors for amino-acid sequences. 2023-04-12 18:38:18
prodec 1.0.2.post5 A package to calculate protein sequence descriptors 2023-01-16 00:36:00
mordred 1.2.0 molecular descriptor calculator 2019-06-05 18:20:01
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