Hi Petr,
It is not possible to use coordinates instead of the atom selection.
Best wishes,
Dorothee
On Tue, May 19, 2020 at 4:31 AM Petr Kolenko <Petr.Kolenko@fjfi.cvut.cz> wrote:
Dear colleagues,
Is there a way to calculate the polder map in a selected box using coordinates instead of atom selection as shown in the "Generating a polder map with the compute_box option" website?
Best regards,
Petr
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