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Some new problems with remake for Catalyst update #3326

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TorkelE opened this issue Jan 15, 2025 · 2 comments · Fixed by SciML/SciMLBase.jl#906
Closed

Some new problems with remake for Catalyst update #3326

TorkelE opened this issue Jan 15, 2025 · 2 comments · Fixed by SciML/SciMLBase.jl#906
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@TorkelE
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TorkelE commented Jan 15, 2025

We previously had problems that conservation law parameters had he wrong value after remake. However, now it seems remake fails when there are involved entirely:

using Catalyst, OrdinaryDiffEqDefault

# Create model.
rs = @reaction_network begin
    @parameters Y0
    @species Y(t) = Y0
    (p,d), 0 <--> Y
    (k1,k2), X1 <--> X2    
end
osys = complete(convert(ODESystem, rs; remove_conserved = true))

# Create initial `ODEProblem`.
u0 = [osys.X1 => 1.0, osys.X2 => 2.0]
ps = [osys.p => 10.0, osys.d => 5.0, osys.Y0 => 3.0, osys.k1 => 1.0, osys.k2 => 2.0]
oprob = ODEProblem(osys, u0, (0.0, 1.0), ps)

# Try `remake`.
u0_new = [osys.X1 => 0.1]
ps_new = [osys.Y0 => 0.3, osys.p => 100.0]
oprob_new = remake(oprob; u0 = u0_new, p = ps_new) # ERROR: TypeError: in validate_parameter_type, in Parameter Γ[1], expected Real, got a value of type SymbolicUtils.BasicSymbolic{Real}

# Check the types of all 6 parameters (5 declared, plus the conservation law one)
for param in parameters(osys)
    println(typeof(param)) # all are `SymbolicUtils.BasicSymbolic{Real}`
end

As a bonus, for some reason, providing an empty u0 in these cases fail (normally work):

oprob_new = remake(oprob; u0 = [], p = ps_new) # ERROR: BoundsError: attempt to access 0-element Vector{Any} at index [1]

@AayushSabharwal Do you have any idea what might be going on?

@TorkelE TorkelE added the bug Something isn't working label Jan 15, 2025
@AayushSabharwal
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That's really weird. Could you share your Project.toml and Manifest.toml?

@TorkelE
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TorkelE commented Jan 15, 2025

(Environment - Catalyst only) pkg> st
Status `~/Desktop/Julia Playground/Environment - Catalyst only/Project.toml`
  [479239e8] Catalyst v14.4.1 `~/.julia/dev/Catalyst`
  [1914dd2f] MacroTools v0.5.15
  [50262376] OrdinaryDiffEqDefault v1.2.0

(Environment - Catalyst only) pkg> st -m
Status `~/Desktop/Julia Playground/Environment - Catalyst only/Manifest.toml`
  [47edcb42] ADTypes v1.11.0
  [1520ce14] AbstractTrees v0.4.5
  [7d9f7c33] Accessors v0.1.41
  [79e6a3ab] Adapt v4.1.1
  [66dad0bd] AliasTables v1.1.3
  [ec485272] ArnoldiMethod v0.4.0
  [4fba245c] ArrayInterface v7.18.0
  [4c555306] ArrayLayouts v1.11.0
  [e2ed5e7c] Bijections v0.1.9
  [62783981] BitTwiddlingConvenienceFunctions v0.1.6
  [8e7c35d0] BlockArrays v1.3.0
  [70df07ce] BracketingNonlinearSolve v1.1.0
  [2a0fbf3d] CPUSummary v0.2.6
  [00ebfdb7] CSTParser v3.4.3
  [479239e8] Catalyst v14.4.1 `~/.julia/dev/Catalyst`
  [d360d2e6] ChainRulesCore v1.25.1
  [fb6a15b2] CloseOpenIntervals v0.1.13
  [861a8166] Combinatorics v1.0.2
  [a80b9123] CommonMark v0.8.15
  [38540f10] CommonSolve v0.2.4
  [bbf7d656] CommonSubexpressions v0.3.1
  [f70d9fcc] CommonWorldInvalidations v1.0.0
  [34da2185] Compat v4.16.0
  [b152e2b5] CompositeTypes v0.1.4
  [a33af91c] CompositionsBase v0.1.2
  [2569d6c7] ConcreteStructs v0.2.3
  [187b0558] ConstructionBase v1.5.8
  [adafc99b] CpuId v0.3.1
  [a8cc5b0e] Crayons v4.1.1
  [9a962f9c] DataAPI v1.16.0
  [864edb3b] DataStructures v0.18.20
  [e2d170a0] DataValueInterfaces v1.0.0
  [2b5f629d] DiffEqBase v6.161.0
  [459566f4] DiffEqCallbacks v4.2.2
  [77a26b50] DiffEqNoiseProcess v5.24.0
  [163ba53b] DiffResults v1.1.0
  [b552c78f] DiffRules v1.15.1
  [a0c0ee7d] DifferentiationInterface v0.6.29
  [8d63f2c5] DispatchDoctor v0.4.19
  [31c24e10] Distributions v0.25.116
  [ffbed154] DocStringExtensions v0.9.3
  [5b8099bc] DomainSets v0.7.14
  [7c1d4256] DynamicPolynomials v0.6.1
  [06fc5a27] DynamicQuantities v1.4.0
  [4e289a0a] EnumX v1.0.4
  [f151be2c] EnzymeCore v0.8.8
  [e2ba6199] ExprTools v0.1.10
⌅ [6b7a57c9] Expronicon v0.8.5
  [7034ab61] FastBroadcast v0.3.5
  [9aa1b823] FastClosures v0.3.2
  [29a986be] FastLapackInterface v2.0.4
  [a4df4552] FastPower v1.1.1
  [1a297f60] FillArrays v1.13.0
  [64ca27bc] FindFirstFunctions v1.4.1
  [6a86dc24] FiniteDiff v2.26.2
  [1fa38f19] Format v1.3.7
  [f6369f11] ForwardDiff v0.10.38
  [069b7b12] FunctionWrappers v1.1.3
  [77dc65aa] FunctionWrappersWrappers v0.1.3
  [d9f16b24] Functors v0.5.2
  [46192b85] GPUArraysCore v0.2.0
  [c27321d9] Glob v1.3.1
  [86223c79] Graphs v1.12.0
  [3e5b6fbb] HostCPUFeatures v0.1.17
  [34004b35] HypergeometricFunctions v0.3.25
  [615f187c] IfElse v0.1.1
  [d25df0c9] Inflate v0.1.5
  [18e54dd8] IntegerMathUtils v0.1.2
  [8197267c] IntervalSets v0.7.10
  [3587e190] InverseFunctions v0.1.17
  [92d709cd] IrrationalConstants v0.2.2
  [82899510] IteratorInterfaceExtensions v1.0.0
  [692b3bcd] JLLWrappers v1.7.0
  [98e50ef6] JuliaFormatter v1.0.62
  [ccbc3e58] JumpProcesses v9.14.1
  [ef3ab10e] KLU v0.6.0
  [ba0b0d4f] Krylov v0.9.8
  [b964fa9f] LaTeXStrings v1.4.0
  [23fbe1c1] Latexify v0.16.5
  [10f19ff3] LayoutPointers v0.1.17
  [5078a376] LazyArrays v2.3.1
  [87fe0de2] LineSearch v0.1.4
  [d3d80556] LineSearches v7.3.0
  [7ed4a6bd] LinearSolve v2.38.0
  [2ab3a3ac] LogExpFunctions v0.3.29
  [bdcacae8] LoopVectorization v0.12.171
  [d8e11817] MLStyle v0.4.17
  [1914dd2f] MacroTools v0.5.15
  [d125e4d3] ManualMemory v0.1.8
  [bb5d69b7] MaybeInplace v0.1.4
  [e1d29d7a] Missings v1.2.0
⌃ [961ee093] ModelingToolkit v9.59.0
  [46d2c3a1] MuladdMacro v0.2.4
  [102ac46a] MultivariatePolynomials v0.5.7
  [d8a4904e] MutableArithmetics v1.6.1
  [d41bc354] NLSolversBase v7.8.3
  [77ba4419] NaNMath v1.0.3
  [8913a72c] NonlinearSolve v4.3.0
  [be0214bd] NonlinearSolveBase v1.4.0
  [5959db7a] NonlinearSolveFirstOrder v1.2.0
  [9a2c21bd] NonlinearSolveQuasiNewton v1.1.0
  [26075421] NonlinearSolveSpectralMethods v1.1.0
  [6fe1bfb0] OffsetArrays v1.15.0
  [429524aa] Optim v1.10.0
  [bac558e1] OrderedCollections v1.7.0
  [6ad6398a] OrdinaryDiffEqBDF v1.2.0
  [bbf590c4] OrdinaryDiffEqCore v1.14.1
  [50262376] OrdinaryDiffEqDefault v1.2.0
  [4302a76b] OrdinaryDiffEqDifferentiation v1.3.0
  [127b3ac7] OrdinaryDiffEqNonlinearSolve v1.3.0
  [43230ef6] OrdinaryDiffEqRosenbrock v1.4.0
  [2d112036] OrdinaryDiffEqSDIRK v1.2.0
  [b1df2697] OrdinaryDiffEqTsit5 v1.1.0
  [79d7bb75] OrdinaryDiffEqVerner v1.1.1
  [90014a1f] PDMats v0.11.31
  [65ce6f38] PackageExtensionCompat v1.0.2
  [d96e819e] Parameters v0.12.3
  [e409e4f3] PoissonRandom v0.4.4
  [f517fe37] Polyester v0.7.16
  [1d0040c9] PolyesterWeave v0.2.2
  [85a6dd25] PositiveFactorizations v0.2.4
  [d236fae5] PreallocationTools v0.4.24
  [aea7be01] PrecompileTools v1.2.1
  [21216c6a] Preferences v1.4.3
  [27ebfcd6] Primes v0.5.6
  [43287f4e] PtrArrays v1.2.1
  [1fd47b50] QuadGK v2.11.1
  [74087812] Random123 v1.7.0
  [e6cf234a] RandomNumbers v1.6.0
  [3cdcf5f2] RecipesBase v1.3.4
  [731186ca] RecursiveArrayTools v3.27.4
  [f2c3362d] RecursiveFactorization v0.2.23
  [189a3867] Reexport v1.2.2
  [ae029012] Requires v1.3.0
  [ae5879a3] ResettableStacks v1.1.1
  [79098fc4] Rmath v0.8.0
  [7e49a35a] RuntimeGeneratedFunctions v0.5.13
  [9dfe8606] SCCNonlinearSolve v1.0.0
  [94e857df] SIMDTypes v0.1.0
  [476501e8] SLEEFPirates v0.6.43
  [0bca4576] SciMLBase v2.70.0
  [19f34311] SciMLJacobianOperators v0.1.1
  [c0aeaf25] SciMLOperators v0.3.12
  [53ae85a6] SciMLStructures v1.6.1
  [efcf1570] Setfield v1.1.1
  [727e6d20] SimpleNonlinearSolve v2.1.0
  [699a6c99] SimpleTraits v0.9.4
  [ce78b400] SimpleUnPack v1.1.0
  [a2af1166] SortingAlgorithms v1.2.1
  [47a9eef4] SparseDiffTools v2.23.1
  [0a514795] SparseMatrixColorings v0.4.10
  [e56a9233] Sparspak v0.3.9
  [276daf66] SpecialFunctions v2.5.0
  [aedffcd0] Static v1.1.1
  [0d7ed370] StaticArrayInterface v1.8.0
  [90137ffa] StaticArrays v1.9.10
  [1e83bf80] StaticArraysCore v1.4.3
  [10745b16] Statistics v1.11.1
  [82ae8749] StatsAPI v1.7.0
  [2913bbd2] StatsBase v0.34.4
  [4c63d2b9] StatsFuns v1.3.2
  [7792a7ef] StrideArraysCore v0.5.7
  [2efcf032] SymbolicIndexingInterface v0.3.37
  [19f23fe9] SymbolicLimits v0.2.2
  [d1185830] SymbolicUtils v3.9.0
  [0c5d862f] Symbolics v6.22.1
  [3783bdb8] TableTraits v1.0.1
  [bd369af6] Tables v1.12.0
  [8ea1fca8] TermInterface v2.0.0
  [1c621080] TestItems v1.0.0
  [8290d209] ThreadingUtilities v0.5.2
  [a759f4b9] TimerOutputs v0.5.26
  [0796e94c] Tokenize v0.5.29
  [d5829a12] TriangularSolve v0.2.1
  [410a4b4d] Tricks v0.1.9
  [781d530d] TruncatedStacktraces v1.4.0
  [5c2747f8] URIs v1.5.1
  [3a884ed6] UnPack v1.0.2
  [1986cc42] Unitful v1.22.0
  [a7c27f48] Unityper v0.1.6
  [3d5dd08c] VectorizationBase v0.21.71
  [19fa3120] VertexSafeGraphs v0.2.0
  [897b6980] WeakValueDicts v0.1.0
  [1d5cc7b8] IntelOpenMP_jll v2024.2.1+0
  [856f044c] MKL_jll v2024.2.0+0
  [efe28fd5] OpenSpecFun_jll v0.5.6+0
  [f50d1b31] Rmath_jll v0.5.1+0
  [1317d2d5] oneTBB_jll v2021.12.0+0
  [0dad84c5] ArgTools v1.1.2
  [56f22d72] Artifacts v1.11.0
  [2a0f44e3] Base64 v1.11.0
  [ade2ca70] Dates v1.11.0
  [8ba89e20] Distributed v1.11.0
  [f43a241f] Downloads v1.6.0
  [7b1f6079] FileWatching v1.11.0
  [9fa8497b] Future v1.11.0
  [b77e0a4c] InteractiveUtils v1.11.0
  [4af54fe1] LazyArtifacts v1.11.0
  [b27032c2] LibCURL v0.6.4
  [76f85450] LibGit2 v1.11.0
  [8f399da3] Libdl v1.11.0
  [37e2e46d] LinearAlgebra v1.11.0
  [56ddb016] Logging v1.11.0
  [d6f4376e] Markdown v1.11.0
  [a63ad114] Mmap v1.11.0
  [ca575930] NetworkOptions v1.2.0
  [44cfe95a] Pkg v1.11.0
  [de0858da] Printf v1.11.0
  [9a3f8284] Random v1.11.0
  [ea8e919c] SHA v0.7.0
  [9e88b42a] Serialization v1.11.0
  [1a1011a3] SharedArrays v1.11.0
  [6462fe0b] Sockets v1.11.0
  [2f01184e] SparseArrays v1.11.0
  [4607b0f0] SuiteSparse
  [fa267f1f] TOML v1.0.3
  [a4e569a6] Tar v1.10.0
  [8dfed614] Test v1.11.0
  [cf7118a7] UUIDs v1.11.0
  [4ec0a83e] Unicode v1.11.0
  [e66e0078] CompilerSupportLibraries_jll v1.1.1+0
  [deac9b47] LibCURL_jll v8.6.0+0
  [e37daf67] LibGit2_jll v1.7.2+0
  [29816b5a] LibSSH2_jll v1.11.0+1
  [c8ffd9c3] MbedTLS_jll v2.28.6+0
  [14a3606d] MozillaCACerts_jll v2023.12.12
  [4536629a] OpenBLAS_jll v0.3.27+1
  [05823500] OpenLibm_jll v0.8.1+2
  [bea87d4a] SuiteSparse_jll v7.7.0+0
  [83775a58] Zlib_jll v1.2.13+1
  [8e850b90] libblastrampoline_jll v5.11.0+0
  [8e850ede] nghttp2_jll v1.59.0+0
  [3f19e933] p7zip_jll v17.4.0+2
Info Packages marked with ⌃ and ⌅ have new versions available. Those with ⌃ may be upgradable, but those with ⌅ are restricted by compatibility constraints from upgrading. To see why use `status --outdated -m`

julia> VERSION
v"1.11.2"

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