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Rename getkey to get and fix it (#66)
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mfherbst committed Feb 6, 2023
1 parent c820c36 commit 0927561
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Showing 9 changed files with 11 additions and 11 deletions.
2 changes: 1 addition & 1 deletion Project.toml
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@@ -1,7 +1,7 @@
name = "AtomsBase"
uuid = "a963bdd2-2df7-4f54-a1ee-49d51e6be12a"
authors = ["JuliaMolSim community"]
version = "0.3.0"
version = "0.3.1"

[deps]
PeriodicTable = "7b2266bf-644c-5ea3-82d8-af4bbd25a884"
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2 changes: 1 addition & 1 deletion docs/src/overview.md
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Expand Up @@ -38,7 +38,7 @@ and implementations of standard functions accessing the properties of the specie
currently
- Geometric information: [`position`](@ref), [`velocity`](@ref), [`n_dimensions`](@ref)
- Atomic information: [`atomic_symbol`](@ref), [`atomic_mass`](@ref), [`atomic_number`](@ref), [`element`](@ref)
- Atomic and system property accessors: `getindex`, `haskey`, `getkey`, `keys`, `pairs`
- Atomic and system property accessors: `getindex`, `haskey`, `get`, `keys`, `pairs`
Based on these methods respective equivalent methods acting
on an `AbstractSystem` will be automatically available, e.g. using the iteration
interface of the `AbstractSystem` (see above). Most of the property accessors on the
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4 changes: 2 additions & 2 deletions docs/src/tutorial.md
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Expand Up @@ -80,7 +80,7 @@ using Unitful, UnitfulAtomic, AtomsBase # hide
deuterium = Atom(1, atomic_symbol=:D, [0, 1, 2.]u"bohr")
````
An equivalent dict-like interface based on `keys`, `haskey`, `getkey` and `pairs`
An equivalent dict-like interface based on `keys`, `haskey`, `get` and `pairs`
is also available. For example
````@example atom
keys(atom)
Expand Down Expand Up @@ -229,7 +229,7 @@ Similar to atoms, systems also support storing arbitrary data, for example
using Unitful, UnitfulAtomic, AtomsBase # hide
system = isolated_system([:H => [0, 0, 1.]u"bohr", :H => [0, 0, 3.]u"bohr"]; extra_data=42)
````
Again these custom properties are fully integrated with `keys`, `haskey`, `pairs` and `getkey`.
Again these custom properties are fully integrated with `keys`, `haskey`, `pairs` and `get`.
````@example sysprop
@show keys(system)
````
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4 changes: 2 additions & 2 deletions src/atom.jl
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Expand Up @@ -24,8 +24,8 @@ n_dimensions(::Atom{D}) where {D} = D

Base.getindex(at::Atom, x::Symbol) = hasfield(Atom, x) ? getfield(at, x) : getindex(at.data, x)
Base.haskey(at::Atom, x::Symbol) = hasfield(Atom, x) || haskey(at.data, x)
function Base.getkey(at::Atom, x::Symbol, default)
hasfield(Atom, x) ? getfield(at, x) : getkey(at.data, x, default)
function Base.get(at::Atom, x::Symbol, default)
hasfield(Atom, x) ? getfield(at, x) : get(at.data, x, default)
end
function Base.keys(at::Atom)
(:position, :velocity, :atomic_symbol, :atomic_number, :atomic_mass, keys(at.data)...)
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2 changes: 1 addition & 1 deletion src/atomview.jl
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Expand Up @@ -19,7 +19,7 @@ Base.show(io::IO, mime::MIME"text/plain", at::AtomView) = show_atom(io, mime, at

Base.getindex(v::AtomView, x::Symbol) = getindex(v.system, v.index, x)
Base.haskey(v::AtomView, x::Symbol) = hasatomkey(v.system, x)
function Base.getkey(v::AtomView, x::Symbol, default)
function Base.get(v::AtomView, x::Symbol, default)
hasatomkey(v.system, x) ? v[x] : default
end
Base.keys(v::AtomView) = atomkeys(v.system)
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2 changes: 1 addition & 1 deletion src/interface.jl
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Expand Up @@ -179,6 +179,6 @@ hasatomkey(system::AbstractSystem, x::Symbol) = all(at -> haskey(at, x), system)

# Defaults for system
Base.pairs(system::AbstractSystem) = (k => system[k] for k in keys(system))
function Base.getkey(system::AbstractSystem, x::Symbol, default)
function Base.get(system::AbstractSystem, x::Symbol, default)
haskey(system, x) ? getindex(system, x) : default
end
2 changes: 1 addition & 1 deletion test/atom.jl
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Expand Up @@ -65,7 +65,7 @@ using Test
:atomic_number, :atomic_mass)
@test hasatomkey(system, :atomic_mass)
@test !hasatomkey(system, :blubber)
@test getkey(system, :blubber, :adidi) == :adidi
@test get(system, :blubber, :adidi) == :adidi

@test collect(pairs(system)) == [
:bounding_box => box, :boundary_conditions => bcs,
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2 changes: 1 addition & 1 deletion test/fast_system.jl
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Expand Up @@ -29,7 +29,7 @@ using PeriodicTable
@test system[2][:position] == [0.75, 0.75, 0.75]u"m"
@test haskey(system[1], :position)
@test !haskey(system[1], :abc)
@test getkey(system[1], :dagger, 3) == 3
@test get(system[1], :dagger, 3) == 3

@test collect(pairs(system)) == [(:bounding_box => box), (:boundary_conditions => bcs)]
@test collect(pairs(system[1])) == [
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2 changes: 1 addition & 1 deletion test/interface.jl
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Expand Up @@ -21,7 +21,7 @@ using PeriodicTable
@test atoms[1][:atomic_number] == 6
@test keys(atoms[1]) == (:position, :velocity, :atomic_symbol,
:atomic_number, :atomic_mass)
@test getkey(atoms[1], :blubber, :adidi) == :adidi
@test get(atoms[1], :blubber, :adidi) == :adidi
end

@testset "System" begin
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@mfherbst
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Registration pull request created: JuliaRegistries/General/77103

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 v0.3.1 -m "<description of version>" 092756182c37a862989da88ebb3fea6c14154388
git push origin v0.3.1

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