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Change base image and add a package to run FahCore_23 #32

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Change base image and add a package to run FahCore_23 #32

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sanori
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@sanori sanori commented Jan 23, 2024 •
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Since FahCore 23 (and OpenMM 8.0.3) requires OpenCL 3.0, we need to upgrade CUDA and Ubuntu versions.

  • Ubuntu: 18.04 -> 22.04 (OpenCL 3.0 is supported since Ubuntu 22.04)
  • CUDA: 11.2.2 -> 11.7.1 (Official CUDA image version that supports Ubuntu 22.04 is 11.7.1)

FahCore 23 requires libexpat1 shared library. So, install libexpat1 package.

This PR resolves Issue #31 .

@manhtruongwang
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Amazing fix, thanks you

@cgint cgint mentioned this pull request Mar 23, 2024
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cgint commented Mar 23, 2024

I faced the same issue as described in #31.

@sanori Thx for your PR

That fixed it for me and now everything works inside docker the same way as on my host machine.

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@sanori @manhtruongwang @cgint