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jgreener64 committed Jul 9, 2023
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### New features
- The Monte Carlo anisotropic barostat is added as `MonteCarloAnisotropicBarostat`, allowing separate pressure coupling in each dimension.
- The Monte Carlo membrane barostat is added as `MonteCarloMembraneBarostat`, allowing pressure coupling for systems involving a membrane.
- A `System` constructor is added to create systems for a SimpleCrystals.jl `Crystal` struct.
- A `System` constructor is added to create systems from a SimpleCrystals.jl `Crystal` struct.
- A convenience constructor is added for `System` allowing an existing `System` to be copied with given properties changed.
- `run_loggers` can be given as a keyword argument to `simulate!` to determine whether the loggers are run. The options are `true`, `false` or `:skipzero`, in which case the loggers are not run before the first step. `run_loggers` is `true` by default except for `SteepestDescentMinimizer`, where it is `false`. `run_loggers!` now has a fourth argument which determines whether the loggers are run, default `true`.
- The scale factor given to `scale_coords!` can now be a `SVector` corresponding to the scaling factor for each axis in addition to a single number.
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Registration pull request created: JuliaRegistries/General/87128

After the above pull request is merged, it is recommended that a tag is created on this repository for the registered package version.

This will be done automatically if the Julia TagBot GitHub Action is installed, or can be done manually through the github interface, or via:

git tag -a v0.17.0 -m "<description of version>" e353dfbd444e2ac4ea05c4aae0b58b3658815445
git push origin v0.17.0

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