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improve figure boxes
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.. container:: version
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This tutorial is compatible with the 2025.1 GROMACS version.

docs/sphinx/source/tutorials/tutorial1/bulk-solution.rst

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@@ -33,7 +33,7 @@ is analyzed using GROMACS utilities, radial distribution functions are
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extracted, and the trajectories are visualized using VMD :cite:`humphrey1996vmd`.
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.. include:: ../../non-tutorials/needhelp.rst
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.. include:: ../../non-tutorials/GROMACS2024.2.rst
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.. include:: ../../non-tutorials/GROMACS2025.1.rst
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..
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The input files
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818Sol MW1 3242 1.130 0.170 2.960
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3.50000 3.50000 3.50000
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.. figure:: ../figures/level1/bulk-solution/step0-light.png
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:alt: Gromacs initial configuration of :math:`\text{SO}_4^{2-}` and :math:`\text{Na}_+` ions visualized with VMD
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.. figure:: figures/populate-box.png
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:alt: Gromacs configuration SO4 Na ions visualized with VMD
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:class: only-light
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.. figure:: ../figures/level1/bulk-solution/step0-dark.png
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:alt: Gromacs initial configuration of :math:`\text{SO}_4^{2-}` and :math:`\text{Na}_+` ions visualized with VMD
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.. figure:: figures/populate-box-dm.png
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:alt: Gromacs configuration SO4 Na ions visualized with VMD
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:class: only-dark
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.. container:: figurelegend
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Figure: :math:`\text{SO}_4^{2-}` ions, :math:`\text{Na}_+` ions, and water molecules.
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Oxygen atoms are in red, hydrogen in white, sodium in blue, and sulfur in
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yellow. For better rendering, the atom representation and colors were
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modified with respect to the default VMD representation.
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yellow. For easier visualization, water molecules are represented as sticks.
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As can be seen using VMD, the water molecules are arranged in a quite
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unrealistic manner, with some molecules being too close. This will need to be
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The molecules and ions have been placed randomly in space, and
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are therefore arranged in a quite unrealistic manner. This will be
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fixed during energy minimization.
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Set the parameters
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