Our Concept of a Structural Equation Model

In our package, a structural equation model (a Sem) is built from one or more loss terms. Fitting the model means finding the parameters that minimize the (weighted) sum of all of its loss terms. This simple idea is remarkably general: within the same structure it covers a single SEM fit by maximum likelihood, a regularized SEM (e.g. maximum likelihood plus a ridge penalty), and multigroup models (one SEM term per group).

SEM concept

A loss term is anything of type AbstractLoss — a function that maps the model parameters to a number that should be minimized. There are two kinds of loss terms:

  • SEM loss functions (SemLoss), such as SemML, SemWLS and SemFIML, measure how well the model explains the data. To do so, each SemLoss bundles its own observed part (the data) and implied part (what the model implies about the data). They are the heart of a SEM.
  • Other loss functions, such as the regularization terms SemRidge and SemConstant, depend only on the parameters and therefore need neither an observed nor an implied part.

Because a model is just a (weighted) sum of loss terms, you can freely combine them. For example, ridge-regularized full information maximum likelihood estimation is a model with two loss terms, a SemFIML term and a SemRidge term. A two-group model is a model with two SemML terms, one per group, weighted by the respective sample sizes.

All models are subtypes of AbstractSem. The default Sem computes the weighted sum of its loss terms together with their (analytic) gradients. SemFiniteDiff is an alternative that approximates the gradient with finite differences, which is useful for loss functions that do not provide an analytic gradient.

The parts of a SEM loss

Each SEM loss function (SemLoss) is itself composed of interchangeable building blocks (like 'Legos'): an observed part and an implied part. To make precise which objects can play each role, we require them to have a certain type:

SEM concept typed

So everything that can serve as the observed part has to be of type SemObserved, everything that can serve as the implied part has to be of type SemImplied, and the loss function that combines them is a SemLoss. To fit the model, you additionally choose a SemOptimizer; it connects to the numerical optimization backend but is not itself part of the model.

Here is an overview on the available building blocks:

SemObservedSemImpliedAbstractLossSemOptimizer
SemObservedDataRAMSemML:Optim
SemObservedCovarianceRAMSymbolicSemWLS:NLopt
SemObservedMissingImpliedEmptySemFIML:Proximal
SemRidge
SemConstant

The rest of this page explains each building block and the available options. After that, the API - model parts section serves as a reference for detailed explanations. (How to stick the building blocks together into a final model is explained in the section on Model Construction.)

The observed part aka SemObserved

The observed part contains all necessary information about the observed data, and pre-computes the statistics a loss function needs from it — for example the observed covariance matrix, or the different patterns of missingness used for full information maximum likelihood (FIML) estimation. Currently, we have three options: SemObservedData for fully observed datasets, SemObservedCovariance for observed covariances (and means) and SemObservedMissing for data that contains missing values.

The implied part aka SemImplied

The implied part defines how the model-implied statistics (for example, the model-implied covariance matrix and mean vector) are computed from the parameters. There are two options at the moment: RAM, which uses the reticular action model to compute the model implied covariance matrix, and RAMSymbolic which does the same but symbolically pre-computes part of the model, which increases subsequent performance in model fitting (see Symbolic precomputation). There is also a third option, ImpliedEmpty that can serve as a 'placeholder' for loss terms that do not need an implied part.

The loss functions aka AbstractLoss

The loss terms specify the objective that is minimized to find the parameter estimates; a model minimizes the (weighted) sum of all its loss terms. SEM loss functions (SemLoss) compare what the model implies to the observed data, while regularization terms depend only on the parameters. Available loss functions are

  • SemML: maximum likelihood estimation
  • SemWLS: weighted least squares estimation
  • SemFIML: full-information maximum likelihood estimation
  • SemRidge: ridge regularization
  • SemConstant: adds a constant to the objective

The optimizer aka SemOptimizer

The optimizer connects to the numerical optimization backend used to fit the model. It is not part of the model itself, but it is chosen when fitting (see Model fitting). It can be used to control options like the optimization algorithm, linesearch, stopping criteria, etc. There are currently three available engines (i.e., backends used to carry out the numerical optimization), :Optim connecting to the Optim.jl backend, :NLopt connecting to the NLopt.jl backend and :Proximal connecting to ProximalAlgorithms.jl. For more information about the available options see also the tutorials about Using Optim.jl and Using NLopt.jl, as well as Constrained optimization and Regularization .

What to do next

You now have an understanding of our representation of structural equation models.

To learn more about how to use the package, you may visit the remaining tutorials.

If you want to learn how to extend the package (e.g., add a new loss function), you may visit Extending the package.

API - model parts

observed

StructuralEquationModels.SemObservedType
abstract type SemObserved

Supertype of all objects that can serve as the observed field of a SEM. Pre-processes data and computes sufficient statistics for example. If you have a special kind of data, you should implement a subtype of SemObserved.

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StructuralEquationModels.SemObservedDataType

For observed data without missings.

Constructor

SemObservedData(;
    data,
    observed_vars = nothing,
    specification = nothing,
    kwargs...)

Arguments

  • data: observed data – DataFrame or Matrix
  • observed_vars::Vector{Symbol}: column names of the data (if the object passed as data does not have column names, i.e. is not a data frame)
  • specification: optional SEM specification (SemSpecification)

Extended help

Interfaces

  • nsamples(::SemObservedData) -> number of observed data points

  • nobserved_vars(::SemObservedData) -> number of observed (manifested) variables

  • samples(::SemObservedData) -> observed data

  • obs_cov(::SemObservedData) -> observed covariance matrix

  • obs_mean(::SemObservedData) -> observed mean vector

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StructuralEquationModels.SemObservedMissingType
SemObservedMissing{T <: Real, S <: Real} <: SemObserved

SemObserved implementation for data with missing values.

Constructor

SemObservedMissing(;
    data,
    observed_vars = nothing,
    specification = nothing,
    lazy_cov = true,
    em_kwargs...)

Arguments

  • data: observed data
  • observed_vars::Vector{Symbol}: column names of the data (if the object passed as data does not have column names, i.e. is not a data frame)
  • specification: optional SEM model specification (SemSpecification)
  • lazy_cov::Bool: whether to defer covariance and mean calculation until requested (default: true)
  • em_kwargs...: keyword arguments to pass to the EM algorithm (see em_mvn)

SemObservedMissing could be used in combination with SemFIML loss for the full information maximum likelihood (FIML) to fit SEM with missing data. It could also be used with other loss functions, e.g. SemML; in that case the approximated observed covariance and mean would be calculated using the EM algorithm (see em_mvn).

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StructuralEquationModels.em_mvnFunction
em_mvn(patterns::AbstractVector{SemObservedMissingPattern};
       max_iter_em = 100,
       rtol_em = 1e-4,
       max_nsamples_em = nothing,
       min_eigval = nothing,
       start_em = start_em_observed,
       start_kwargs...)

Estimate the covariance and the mean for data with missing values using the expectation maximization (EM) algorithm.

Arguments

  • patterns: the observed data with missing values, grouped by missingness pattern (each pattern is a SemObservedMissingPattern)
  • max_iter_em: the maximum number of EM iterations
  • rtol_em: the relative tolerance for convergence of the EM algorithm
  • max_nsamples_em: the maximum number of samples to use for each pattern in each EM iteration, by default all samples are used, but for large datasets it may be desirable to use a random subset of the data for each pattern in each EM iteration to speed up the algorithm
  • min_eigval: the minimum eigenvalue for the covariance matrix; if not nothing, the covariance matrix is regularized in each EM iteration to ensure that all eigenvalues are not smaller than min_eigval, which can help with convergence;
  • start_em: the function to generate starting values for the EM algorithm, by default start_em_observed which uses the mean and covariance of the full cases if available
  • start_kwargs...: keyword arguments to pass to the start_em function

Returns the tuple of the covariance matrix and the mean vector for the estimated multivariate normal (MVN) distribution.

References

Based on the EM algorithm for MVN-distributed data with missing values adapted from the supplementary material to the book Machine Learning: A Probabilistic Perspective, copyright (2010) Kevin Murphy and Matt Dunham: see gaussMissingFitEm.m and emAlgo.m scripts.

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implied

StructuralEquationModels.SemImpliedType

Supertype of all objects that can serve as the implied field of a SEM. Computes model-implied values that should be compared with the observed data to find parameter estimates, e. g. the model implied covariance or mean. If you would like to implement a different notation, e.g. LISREL, you should implement a subtype of SemImplied.

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StructuralEquationModels.RAMType

Model implied covariance and means via RAM notation.

Constructor

RAM(specification; gradient = true, kwargs...)

Arguments

  • specification: either a RAMMatrices or ParameterTable object
  • gradient::Bool: is gradient-based optimization used

Extended help

RAM notation

The model implied covariance matrix is computed as

\[ \Sigma = F(I-A)^{-1}S(I-A)^{-T}F^T\]

and for models with a meanstructure, the model implied means are computed as

\[ \mu = F(I-A)^{-1}M\]

Interfaces

  • param_labels(::RAM)-> vector of parameter labels

  • nparams(::RAM) -> number of parameters

  • ram.Σ -> model implied covariance matrix

  • ram.μ -> model implied mean vector

RAM matrices for the current parameter values:

  • ram.A
  • ram.S
  • ram.F
  • ram.M

Jacobians of RAM matrices w.r.t to the parameter vector θ

  • ram.∇A -> $∂vec(A)/∂θᵀ$
  • ram.∇S -> $∂vec(S)/∂θᵀ$
  • ram.∇M = $∂M/∂θᵀ$

Vector of indices of each parameter in the respective RAM matrix:

  • ram.A_indices
  • ram.S_indices
  • ram.M_indices

Additional interfaces

  • F⨉I_A⁻¹(::RAM) -> $F(I-A)^{-1}$
  • F⨉I_A⁻¹S(::RAM) -> $F(I-A)^{-1}S$
  • I_A(::RAM) -> $I-A$

Only available in gradient! calls:

  • ram.I_A⁻¹ -> $(I-A)^{-1}$
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StructuralEquationModels.RAMSymbolicType

Subtype of SemImplied that implements the RAM notation with symbolic precomputation.

Constructor

RAMSymbolic(
    specification;
    vech = false,
    gradient = true,
    hessian = false,
    approximate_hessian = false,
    kwargs...)

Arguments

  • specification: either a RAMMatrices or ParameterTable object
  • gradient::Bool: is gradient-based optimization used
  • hessian::Bool: is hessian-based optimization used
  • approximate_hessian::Bool: for hessian based optimization: should the hessian be approximated
  • vech::Bool: should the half-vectorization of Σ be computed (instead of the full matrix) (automatically set to true if any of the loss functions is SemWLS)

Extended help

Interfaces

  • param_labels(::RAMSymbolic)-> vector of parameter ids

  • nparams(::RAMSymbolic) -> number of parameters

  • ram.Σ -> model implied covariance matrix

  • ram.μ -> model implied mean vector

Jacobians (only available in gradient! calls)

  • ram.∇Σ -> $∂vec(Σ)/∂θᵀ$

  • ram.∇μ -> $∂μ/∂θᵀ$

  • ∇Σ_eval!(::RAMSymbolic) -> function to evaluate ∇Σ in place, i.e. ∇Σ_eval!(∇Σ, θ). Typically, you do not want to use this but simply query ram.∇Σ.

Hessians The computation of hessians is more involved. Therefore, we desribe it in the online documentation, and the respective interfaces are omitted here.

RAM notation

The model implied covariance matrix is computed as

\[ \Sigma = F(I-A)^{-1}S(I-A)^{-T}F^T\]

and for models with a meanstructure, the model implied means are computed as

\[ \mu = F(I-A)^{-1}M\]

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StructuralEquationModels.ImpliedEmptyType

Empty placeholder for models that don't need an implied part. (For example, models that only regularize parameters.)

Constructor

ImpliedEmpty(specification; kwargs...)

Arguments

  • specification: either a RAMMatrices or ParameterTable object

Examples

A multigroup model with ridge regularization could be specified as a Sem with one SEM term (SemLoss) per group and an additional SemRidge regularization term.

Extended help

Interfaces

  • param_labels(::ImpliedEmpty)-> Vector of parameter labels
  • nparams(::ImpliedEmpty) -> Number of parameters
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loss functions

StructuralEquationModels.SemLossType
abstract type SemLoss{O <: SemObserved, I <: SemImplied} <: AbstractLoss

The base type for calculating the loss of the implied SEM model when explaining the observed data.

All subtypes of SemLoss should have the following fields:

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StructuralEquationModels.SemMLType

Maximum likelihood estimation.

Constructor

SemML(observed, implied, refloss = nothing; approximate_hessian = false)

Arguments

  • observed::SemObserved: the observed part of the model
  • implied::SemImplied: SemImplied instance
  • refloss::Union{SemML, Nothing}: optional reference loss used to preserve loss-specific configuration and share the internal state when rebuilding a loss term, e.g. in replace_observed
  • approximate_hessian::Bool: if hessian-based optimization is used, should the hessian be swapped for an approximation

Examples

my_ml = SemML(my_observed, my_implied)

Interfaces

Analytic gradients are available, and for models without a meanstructure and RAMSymbolic implied type, also analytic hessians.

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StructuralEquationModels.SemFIMLType
SemFIML{O, I, T, W} <: SemLoss{O, I}

Full information maximum likelihood (FIML) estimation. Can handle observed data with missing values.

Constructor

SemFIML(observed::SemObservedMissing, implied::SemImplied, refloss = nothing)

Arguments

  • observed::SemObservedMissing: the observed part of the model (see SemObservedMissing)
  • implied::SemImplied: the implied part of the model (see SemImplied)
  • refloss::Union{SemFIML, Nothing}: optional reference loss used to preserve loss-specific configuration and share the internal state when rebuilding a loss term, e.g. in replace_observed

Examples

my_fiml = SemFIML(my_observed, my_implied)

Interfaces

Analytic gradients are available.

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StructuralEquationModels.SemWLSType

Weighted least squares estimation. At the moment only available with the RAMSymbolic implied type.

Constructor

SemWLS(
    observed::SemObserved, implied::SemImplied, refloss = nothing;
    wls_weight_matrix = nothing,
    wls_weight_matrix_mean = nothing,
    approximate_hessian = false,
    kwargs...)

Arguments

  • observed: the SemObserved part of the model
  • implied: the SemImplied part of the model
  • refloss::Union{SemWLS, Nothing}: optional reference loss used to preserve loss-specific configuration and share the internal state when rebuilding a loss term, e.g. in replace_observed
  • approximate_hessian::Bool: should the hessian be swapped for an approximation
  • wls_weight_matrix: the weight matrix for weighted least squares. Defaults to GLS estimation ($0.5*(D^T*kron(S,S)*D)$ where D is the duplication matrix and S is the inverse of the observed covariance matrix)
  • wls_weight_matrix_mean: the weight matrix for the mean part of weighted least squares. Defaults to GLS estimation (the inverse of the observed covariance matrix)

Examples

my_wls = SemWLS(my_observed, my_implied)

Interfaces

Analytic gradients are available, and for models without a meanstructure also analytic hessians.

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StructuralEquationModels.SemRidgeType

Ridge regularization.

Constructor

SemRidge(;α_ridge, which_ridge, nparams, parameter_type = Float64, implied = nothing, kwargs...)

Arguments

  • α_ridge: hyperparameter for penalty term
  • which_ridge::Vector: Vector of parameter labels (Symbols) or indices that indicate which parameters should be regularized.
  • nparams::Int: number of parameters of the model
  • implied::SemImplied: implied part of the model
  • parameter_type: type of the parameters

Examples

my_ridge = SemRidge(;α_ridge = 0.02, which_ridge = [:λ₁, :λ₂, :ω₂₃], nparams = 30, implied = my_implied)

Interfaces

Analytic gradients and hessians are available.

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StructuralEquationModels.SemConstantType
SemConstant{C <: Number} <: AbstractLoss

Constant loss term. Can be used for comparability to other packages.

Constructor

SemConstant(;constant_loss, kwargs...)

Arguments

  • constant_loss::Number: constant to add to the objective

Examples

    my_constant = SemConstant(42.0)

Interfaces

Analytic gradients and hessians are available.

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optimizer

StructuralEquationModels.optimizer_enginesFunction
optimizer_engines()

Returns a vector of optimizer engines supported by the engine keyword argument of the SemOptimizer constructor.

The list of engines depends on the Julia packages loaded (with the using directive) into the current session.

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StructuralEquationModels.SemOptimizerType
SemOptimizer(args...; engine::Symbol = :Optim, kwargs...)

Constructs a SemOptimizer object that can be passed to fit for specifying aspects of the numerical optimization involved in fitting a SEM.

The keyword engine controlls which Julia package is used, with :Optim being the default.

More engines become available if specific packages are loaded, for example NLopt.jl (also see Constrained optimization in the online documentation) or ProximalAlgorithms.jl (also see Regularization in the online documentation).

The arguments args... and kwargs... are engine-specific and control further aspects of the optimization process, such as the algorithm, convergence criteria or constraints. Information on those can be accessed with optimizer_engine_doc.

Custom optimizer types shows how to connect the SEM.jl package to a completely new optimization engine.

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StructuralEquationModels.SemOptimizerOptimType
SemOptimizer(;
    engine = :Optim,
    algorithm = LBFGS(),
    options = Optim.Options(;f_reltol = 1e-10, x_abstol = 1.5e-8),
    kwargs...)

Connects to Optim.jl as the optimization engine.

For more information on the available algorithms and options, see the Optim.jl docs.

Arguments

  • algorithm: optimization algorithm from Optim.jl
  • options::Optim.Options: options for the optimization algorithm

Examples

# hessian based optimization with backtracking linesearch and modified initial step size
using Optim, LineSearches

my_newton_optimizer = SemOptimizer(
    engine = :Optim,
    algorithm = Newton(
        ;linesearch = BackTracking(order=3),
        alphaguess = InitialHagerZhang()
    )
)

Constrained optimization

When using the Fminbox or SAMIN constrained optimization algorithms, the vector or dictionary of lower and upper bounds for each model parameter can be specified via lower_bounds and upper_bounds keyword arguments. Alternatively, the lower_bound and upper_bound keyword arguments can be used to specify the default bound for all non-variance model parameters, and the variance_lower_bound and variance_upper_bound keyword – for the variance parameters (the diagonal of the S matrix).

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SEMNLOptExt.SemOptimizerNLoptType
SemOptimizer(;
    engine = :NLopt,
    algorithm = :LD_LBFGS,
    options = Dict{Symbol, Any}(),
    local_algorithm = nothing,
    local_options = Dict{Symbol, Any}(),
    equality_constraints = nothing,
    inequality_constraints = nothing,
    constraint_tol::Number = 0.0,
    kwargs...)

Uses NLopt.jl as the optimization engine. For more information on the available algorithms and options, see the NLopt.jl package and the NLopt docs.

Arguments

  • algorithm: optimization algorithm.
  • options::Dict{Symbol, Any}: options for the optimization algorithm
  • local_algorithm: local optimization algorithm
  • local_options::Dict{Symbol, Any}: options for the local optimization algorithm
  • `equality_constraints: optional equality constraints
  • `inequality_constraints:: optional inequality constraints
  • constraint_tol::Number: default tolerance for constraints

Constraints specification

Equality and inequality constraints arguments could be a single constraint or any iterable constraints container (e.g. vector or tuple). Each constraint could be a function or any other callable object that takes the two input arguments:

  • the vector of the model parameters;
  • the array for the in-place calculation of the constraint gradient.

To override the default tolerance, the constraint can be specified as a pair of the function and its tolerance: constraint_func => tol. For information on how to use inequality and equality constraints, see Constrained optimization in our online documentation.

Example

my_optimizer = SemOptimizer(engine = :NLopt)

# constrained optimization with augmented lagrangian
my_constrained_optimizer = SemOptimizer(;
    engine = :NLopt,
    algorithm = :AUGLAG,
    local_algorithm = :LD_LBFGS,
    local_options = Dict(:ftol_rel => 1e-6),
    inequality_constraints = (my_constraint => tol),
)

Interfaces

  • algorithm(::SemOptimizerNLopt)
  • local_algorithm(::SemOptimizerNLopt)
  • options(::SemOptimizerNLopt)
  • local_options(::SemOptimizerNLopt)
  • equality_constraints(::SemOptimizerNLopt)
  • inequality_constraints(::SemOptimizerNLopt)
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SEMProximalOptExt.SemOptimizerProximalType
SemOptimizerProximal(;
    algorithm = ProximalAlgorithms.PANOC(),
    operator_g,
    operator_h = nothing,
    kwargs...,
)

Connects to ProximalAlgorithms.jl as the optimization backend. For more information on the available algorithms and options, see the online docs on Regularization and the documentation of ProximalAlgorithms.jl / ProximalOperators.jl.

Arguments

  • algorithm: proximal optimization algorithm.
  • operator_g: proximal operator (e.g., regularization penalty)
  • operator_h: optional second proximal operator
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