QM4D is a quantum mechanical (QM)/molecular mechanical (MM) molecular dynamics (MD) simulation package.
QM4D is an in-house program
used by Dr. Weitao Yang's research group. The software project was
started by Xiangqian Hu and Hao Hu, who wrote most of the essential
routines. The program is intended to be released as open source software
soon, after all the cleanup is completed. If you want to test it now,
use the following command:
git clone https://qm4d.org/git/qm4d
You will need an username and a password (you can register using Trac,
the link is at the bottom of the page). Please note that the registration
itself is not sufficient, and the newly created account has to be authorized
by the site maintainer. To make this happen, contact
Weitao Yang
or
Tomasz Janowski (the site admin)
and explain in a few words why you need the software.
In the long run the code will
be made freely available to the public without a password. Uploading
revisions to the code will always require authorization.
We have recently deployed a communication tool for research and
development purposes based on Mattermost software. The link is listed
below. If you need to specify it explicitly in e.g. an Android app then
paste the following:
https://qm4d.org:8065/
This website is dedicated to developers and senior users in order to develop and maintain the QM4D source code. To join our team, whether as a developer or an user, please contact the group leader Dr. Weitao Yang or the site admin Tomasz Janowski.