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Update installation docs #298

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mattwthompson opened this issue Nov 14, 2023 · 2 comments
Open

Update installation docs #298

mattwthompson opened this issue Nov 14, 2023 · 2 comments

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@mattwthompson
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Description

The installation docs are a little out of date: https://docs.openforcefield.org/projects/bespokefit/en/stable/getting-started/installation.html

They include

  • Psi4 pulling from defaults
  • Psi4 not looking into https://psicode.org/installs/v182/ which it currently recommends
  • Possibly pulling in openff-qcsubmit >=0.50 or qcportal >=0.50
@mattwthompson
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conda-forge/openff-bespokefit-feedstock#19

@mattwthompson
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In #299 I've updated them to reflect the current state of needing qcportal <0.50; this should not last long either with the above repodata patch merged or an upcoming release using qcportal >=0.50. But the live docs should be accurate

@mattwthompson mattwthompson mentioned this issue Oct 10, 2024
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