FrAG · PyPI

FrAG, a new tool for in silico hit-to-lead drug design, capable of growing a frag_pelement into a core while exploring the protein-ligand conformational space

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Project links

Intended Audience
- Science/Research
License
- OSI Approved :: MIT License
Operating System
- POSIX :: Linux
Programming Language
- Python :: 2.7
- Python :: 3

Project description

FrAG-PELE:

A novel fragment-based growing tool for hit-to-lead in drug design

Installation

https://carlesperez94.github.io/frag_pele/installation.html

Getting Started:

https://carlesperez94.github.io/frag_pele/first_steps.html

Project details

These details have not been verified by PyPI

Project links

Intended Audience
- Science/Research
License
- OSI Approved :: MIT License
Operating System
- POSIX :: Linux
Programming Language
- Python :: 2.7
- Python :: 3

Release history Release notifications | RSS feed

This version

1.1.0

Aug 19, 2019

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FrAG-1.1.0.tar.gz (236.4 kB view details)

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Download URL: FrAG-1.1.0.tar.gz
Upload date: Aug 19, 2019
Size: 236.4 kB
Tags: Source
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