BSD Ports

wip/py-chemlab 0.3 NetBSD

The python chemistry library you were waiting for

System
NetBSD
Repository
pkgsrc-wip
Maintainer
[email protected]
License
gnu-gpl-v3
Categories
wip, biology

Description

chemlab is a python library and a set of utilities built to ease the life of the computational chemist. It takes inspiration from other python scientific library such as numpy scipy and matplotlib, and aims to bring a consistent and simple API by following the python guidelines.

Computational and theoretical chemistry is a huge field, and providing a program that encompasses all aspects of it is an impossible task. The spirit of chemlab is to provide a common ground from where you can build specific programs. For this reason it includes an easily extendable molecular viewer and flexible data structures field-independent

Install

From pkgsrc-wip (no binary package):

cd /usr/pkgsrc/wip/py-chemlab && make install clean

Dependencies

Build dependencies 1
Run dependencies 3

No port depends on this one.