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New tool poisson_integrator_conv #752

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New tool poisson_integrator_conv #752

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jhenin
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@jhenin jhenin commented Nov 29, 2024

Useful to investigate the convergence of Poisson integration.
Contains small improvements to the existing standalone integration tool, eg: 3D files are written to DX format.
Adds a constructor of colvar_grid_scalar from a filename (reading a multicol file) which will be useful for future improvements.

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