Statistical analysis tool to help identify molecular fragments that promote, or detract from, target properties.
Sepecifically, this tool calculates the “z-scores” of molecular substructures in a given sub-population of a database to identify fragments that are over- or under-represented in this sub-population relative to a reference population. These substructures can either be specified by the user, or automatically generated using Morgan fingerprints.
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Release files for molz 0.1.2
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Source distribution (sdist)
| File | Size | Uploaded | Provenance | Actions |
|---|---|---|---|---|
| molz-0.1.2.tar.gz | 6.6 kB | Without provenance | Details for molz-0.1.2.tar.gz |
Built distribution (wheel)
| File | Interpreter | ABI | Platform | Actions Reset |
|---|---|---|---|---|
| molz-0.1.2-py3-none-any.whl | Python 3 | none | any | Details for molz-0.1.2-py3-none-any.whl |
Total release size: 13.0 kB
Release files / molz-0.1.2.tar.gz
| Download URL | molz-0.1.2.tar.gz |
|---|---|
| Size | 6.6 kB |
| Tags | Source |
|
SHA-256 checksum How to use checksums |
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BLAKE2b-256 checksum How to use checksums |
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twine/3.2.0 pkginfo/1.6.1 requests/2.25.0 setuptools/50.3.2.post20201201 requests-toolbelt/0.9.1 tqdm/4.54.1 CPython/3.8.0
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Release files / molz-0.1.2-py3-none-any.whl
| Download URL | molz-0.1.2-py3-none-any.whl |
|---|---|
| Size | 6.4 kB |
| Tags | Python 3 |
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SHA-256 checksum How to use checksums |
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twine/3.2.0 pkginfo/1.6.1 requests/2.25.0 setuptools/50.3.2.post20201201 requests-toolbelt/0.9.1 tqdm/4.54.1 CPython/3.8.0
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Security for molz 0.1.2
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