amp-v0.6.tar.gz (4.02 MB)

Amp: The Atomistic Machine-learning Package v0.6

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posted on 31.07.2017, 00:00 by Khorshidi, Alireza, El Khatib, Muammar, Peterson*, Andrew

*Amp* is an open-source package designed to easily bring machine-learning to atomistic calculations. This project is being developed at Brown University in the School of Engineering, primarily by Andrew Peterson and Alireza Khorshidi, and is released under the GNU General Public License.  *Amp* allows for the modular representation of the potential energy surface, enabling the user to specify or create descriptor and regression methods.

This project lives at:

Documentation lives at:

Users' mailing list lives at:

If you would like to compile a local version of the documentation, see the README file in the docs directory.

*Corresponding author: