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AnyPyTools

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AnyPyTools is a toolkit for working with the AnyBody Modeling System (AMS) from Python. Its main purpose is to launch AnyBody simulations and collect results. It has a scheduler to launch multiple instances of AMS utilising computers with multiple cores. AnyPyTools makes it possible to run parameter and Monte Carlo studies more efficiently than from within AMS.

Installation

conda install -c melund anypytools

Usage

The simplest case:

from anypytools import AnyPyProcess
app = AnyPyProcess()
macro = [['load "Model.main.any"',
          'operation Main.Study.InverseDynamics',
          'run' ]]
app.start_macro(macro)

Please see this tutorial on how to use the library.

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Python tools and utilities for working with the AnyBody Modelling System

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