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Skip writing boron-silicon-atom_par.dat from mk_prepare_receptor.py ; add the dat to JSON files in meeko/data/ #282

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rwxayheee opened this issue Dec 13, 2024 · 0 comments
Open

Skip writing boron-silicon-atom_par.dat from mk_prepare_receptor.py ; add the dat to JSON files in meeko/data/ #282

rwxayheee opened this issue Dec 13, 2024 · 0 comments

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@rwxayheee
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Since AutoGrid v4.2.8 additional parameters of boron and silicon are no longer needed.
@rwxayheee rwxayheee changed the title Skip writing boron-silicon-atom_par.dat; add the dat to JSON files in meeko/data/ Skip writing boron-silicon-atom_par.dat from mk_prepare_receptor.py ; add the dat to JSON files in meeko/data/ Dec 13, 2024
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