Pele platform is a python module to automatically launch PELE, AdaptivePELE, MSMPELE and FragPELE. It is built as a python layer on top of all PELE functionalities that can be used as a backend for a potential future GUI.
PELE_Platform Functionalities
Automatically prepare and launch PELE & FragPELE input
Install
https://nostrumbiodiscovery.github.io/pele_platform/installation/index.html
Get Started
https://nostrumbiodiscovery.github.io/pele_platform/tutorial/index.html
Documentation of the input parameters
https://nostrumbiodiscovery.github.io/pele_platform/documentation/index.html
What’s new
https://nostrumbiodiscovery.github.io/pele_platform/changelog/index.html
Metadata
Release files for pele-platform 1.6.4
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Source distribution (sdist)
| File | Size | Uploaded | Provenance | Actions |
|---|---|---|---|---|
| pele_platform-1.6.4.tar.gz | 12.3 MB | Without provenance | Details for pele_platform-1.6.4.tar.gz |
Release files / pele_platform-1.6.4.tar.gz
| Download URL | pele_platform-1.6.4.tar.gz |
|---|---|
| Size | 12.3 MB |
| Tags | Source |
|
SHA-256 checksum How to use checksums |
8fc7df3aeacf738df7be54f45ff1371ead1799e4f5ffad614dbce6135c3aba21
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BLAKE2b-256 checksum How to use checksums |
edc6d0bed283cb52725f3de771dca5a44915ca192e19f4b13384957b0b99e6ee
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| Upload date | |
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Uploaded using Trusted Publishing? What is trusted publishing? |
No |
| Uploaded via |
twine/4.0.1 CPython/3.10.5
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Security for pele-platform 1.6.4
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