Autodock scipion plugin
Documentation under development, sorry for the inconvenience
Scipion framework plugin for the use of tools provided by Autodock software suite.
Full documentation to this plugin can be found in the official documentation page.
Install this plugin
You will need to use 3.0.0 version of Scipion to run these protocols. To install the plugin, you have two options:
Stable version
scipion installp -p scipion-chem-autodockOR
through the plugin manager GUI by launching Scipion and following Configuration >> Plugins
Developer’s version
Download repository:
git clone https://github.com/scipion-chem/scipion-chem-autodock.gitSwitch to the desired branch (master or devel):
Scipion-chem-autodock is constantly under development. If you want a relatively older an more stable version, use master branch (default). If you want the latest changes and developments, user devel branch.
cd scipion-chem-autodock
git checkout develInstall:
scipion installp -p path_to_scipion-chem-autodock --develBinary files
Atom_struct_utils plugin is a pure Python module, no binary files are required.
Tests
To check the installation, simply run the following Scipion test:
Buildbot status
Status devel version:
Status production version:
1 maintainer
Metadata
1 maintainer
Release files for scipion-chem-autodock 3.3.3
For a detailed explanation of source distributions (sdists) and built distributions (wheels), please see the package formats documentation.
Source distribution (sdist)
| File | Size | Uploaded | Provenance | Actions |
|---|---|---|---|---|
| scipion_chem_autodock-3.3.3.tar.gz | 107.2 kB | Without provenance | Details for scipion_chem_autodock-3.3.3.tar.gz |
Built distribution (wheel)
| File | Interpreter | ABI | Platform | Actions Reset |
|---|---|---|---|---|
| scipion_chem_autodock-3.3.3-py3-none-any.whl | Python 3 | none | any | Details for scipion_chem_autodock-3.3.3-py3-none-any.whl |
Total release size: 243.4 kB
Release files / scipion_chem_autodock-3.3.3.tar.gz
| Download URL | scipion_chem_autodock-3.3.3.tar.gz |
|---|---|
| Size | 107.2 kB |
| Tags | Source |
|
SHA-256 checksum How to use checksums |
da6b3632a0467b96733bb00a759326182696af85ca13ef9d2f0ff855432fde56
|
|
BLAKE2b-256 checksum How to use checksums |
a17a5e1b5de7e118bc9f050fc9eb235523dcd40773b656c1ea4394787249e3c1
|
| Upload date | |
|
Uploaded using Trusted Publishing? What is trusted publishing? |
No |
| Uploaded via |
twine/7.0.0 CPython/3.10.22
|
Release files / scipion_chem_autodock-3.3.3-py3-none-any.whl
| Download URL | scipion_chem_autodock-3.3.3-py3-none-any.whl |
|---|---|
| Size | 136.2 kB |
| Tags | Python 3 |
|
SHA-256 checksum How to use checksums |
d76371e6287a0bf37a68624592faf8b50128d7d316e5ff49579f134a0c03f37e
|
|
BLAKE2b-256 checksum How to use checksums |
cb2ef4f63aad01bfaa103ffabc54ce131ee29e00d5bca44d91037898e7ffd1d1
|
| Upload date | |
|
Uploaded using Trusted Publishing? What is trusted publishing? |
No |
| Uploaded via |
twine/7.0.0 CPython/3.10.22
|
Security for scipion-chem-autodock 3.3.3
Provenance
Provenance describes where a file came from. On PyPI, provenance is shared via attestations, which provide a verifiable record of the build or publishing details. View details, limitations and caveats.
No provenance found
None of the files in this release were uploaded with provenance metadata.
A note on package security
PyPI is a repository for distributing packages, not a service for auditing them. While third-party security researchers and our staff do their best to detect and remove malicious packages, PyPI cannot guarantee the quality, security or suitability of any given package.
To learn more about protecting yourself from malicious actors, visit our package security documentation.
