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<h1><strong>Software Suite for Advanced General Ensemble Simulations</strong></h1>
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<h3>SSAGES provides a unified, extensible framework to calculate reaction
coordinates and reactive pathways, and free energies within generic molecular
simulations.</h3>
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<h2>Open-source</h2>
<div>SSAGES is distributed under the GNU General Public License (v3.0). It
is developed at Argonne National Laboratory in conjuction with the
University of Chicago and the University of Notre Dame.</div>
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<h2>Interoperable</h2>
<div>SSAGES is designed from the ground up to connect to arbitrary molecular
simulation codes through minimal programming effort. It targets specific
interoperability with open-source code such as GROMACS, LAMMPS and
HOOMD-blue, and continues to grow to support other open-source, proprietary,
and bespoke codes.<br><br></div>
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<h2>Versatile</h2>
<div>SSAGES implements several methods for reactive pathway identification
and free energy measurement, including Forward Flux Sampling, Metadynamics,
and Nudged Elastic Band methods.</div>
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<h2 class="archive__item-title">Conformations of the alanine dipeptide in SSAGES</h2>
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<p>This video shows the isomerization of alanine dipeptide;<br>
all calculations were performed in SSAGES</p>
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<p>This figure depicts a simple validation of the metadynamics and elastic
band method codes in SSAGES of a system with a single particle within a two
dimensional field containing three Gaussian potentials, one peak and two
wells.</p>
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<p class="h2-subheadline">Join the SSAGES community to contribute, learn, and get your questions answered.</p>
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<p class="card-summary">Discuss advanced topics. <a href="https://slackinvite.julialang.org/">Request access here</a>.</p>
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