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General Automated Atomic Model Parameterization (GAAMP)

Licensed according to this deed.

Category

Science Gateways

Published on

Abstract

The web server will automatically optimize the parameters of a force field for a desired molecule based on ab initio data. The web server will automatically optimize the parameters of a force field for a desired molecule based on ab initio data.

Email

roux@uchicago.edu,lhuang3@uchicago.edu

Site

http://gaamp.lcrc.anl.gov/

Documents

More Information: http://memprotein.org/core-facilities/computational-modeling

Users

cyoun

Cite this work

Researchers should cite this work as follows:

  • (2024), "General Automated Atomic Model Parameterization (GAAMP)," https://sciencegateways.org/resources/generalautomatedatomicmodelparameterizationgaamp.

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Tags

  1. force field
  2. GAAMP
  3. molecule