piwheels

pyscreener

pythonic interface to virtual screening software

Installation

In a virtualenv (see these instructions if you need to create one):

pip3 install pyscreener

Dependencies

• colorama
• tqdm
• numpy
• h5py
• pandas
• scipy
• pdbfixer
• configargparse
• ray

Releases

Version	Released	Bookworm Python 3.11	Trixie Python 3.13	Files
1.2.3	2022-12-14
pyscreener-1.2.3-py3-none-any.whl (51 KB)
1.2.2	2022-04-19
pyscreener-1.2.2-py3-none-any.whl (50 KB)
1.2.1	2022-04-13
pyscreener-1.2.1-py3-none-any.whl (50 KB)
1.2.0	2022-03-17
pyscreener-1.2.0-py3-none-any.whl (50 KB)
1.1.1	2021-10-22
pyscreener-1.1.1-py3-none-any.whl (50 KB)
1.1.0	2021-10-22
pyscreener-1.1.0-py3-none-any.whl (48 KB)
1.0.0	2021-10-21
pyscreener-1.0.0-py3-none-any.whl (48 KB)

Issues with this package?

• Search issues for this package
• Package or version missing? Open a new issue
• Something else? Open a new issue