Developer(s) Schrödinger, LLC Available in English | Development status Active | |
Initial release 2000; 17 years ago (2000) Stable release 11.3 / March 2016; 1 year ago (2016-03) Operating system |
MacroModel is a computer program for molecular modelling of organic compounds and biopolymers. It features various chemistry force fields, plus energy minimizing algorithms, to predict geometry and relative conformational energies of molecules. MacroModel is maintained by Schrödinger, LLC.
It performs simulations in the framework of classical mechanics, also termed molecular mechanics, and can perform molecular dynamics simulations to model systems at finite temperatures using stochastic dynamics and mixed Monte Carlo algorithms. MacroModel supports Windows, Linux, macOS, Silicon Graphics (SGI) IRIX, and IBM AIX.
Known version history
References
MacroModel Wikipedia(Text) CC BY-SA