# `cppls` — Powered PLS (Indahl 2005) _Group_: **Core PLS** · _Registry tolerance_: `1e-08` ## Description CPPLS (Canonical Powered PLS, Indahl Liland & Næs 2009) From the `pls4all.sklearn.CPPLSRegression` docstring: > Canonical Powered PLS (Indahl, Liland & Næs 2009). > **Registry note** — R `pls::cppls 2.9.0` Canonical Powered PLS (lower=upper=0.5 default reduces to NIPALS PLS1 with X-only deflation for q=1). pls4all matches at ~8e-16. SIMPLS column-σ^γ variant via cfg.solver = SIMPLS. ### Parameters | Name | Type | Default | Notes | |------|------|---------|-------| | `n_components` | `int` | `2` | Number of latent components extracted (k). | | `gamma` | `float` | `0.5` | Covariance/correlation mixing exponent (0 → covariance-maximizing PLS, 1 → correlation-maximizing). | | `solver` | `—` | `None` | Inner algorithm: 'nipals', 'simpls', 'svd', 'kernel', 'orthogonal-scores', 'power', 'randomized-svd', 'wide-kernel'. | ## Explanations ### Bibliographic source Indahl, U. G. (2005). *A twist to partial least squares regression*. Journal of Chemometrics 19(1), 32–44. ### Mathematical principle Powered PLS introduces a single hyperparameter $\gamma \in [0, 1]$ that morphs the loading-weight definition between PCA ($\gamma=0$) and PLS ($\gamma=1$). Concretely, the loading weight is $\mathbf{w} \propto \operatorname{sign}(\mathbf{X}^{\top}\mathbf{y}) \odot |\mathbf{X}^{\top}\mathbf{y}|^{\gamma}$ where $\odot$ is the element-wise product. When $\mathbf{X}$ carries weakly informative columns alongside strongly informative ones, raising the covariance to a power $\gamma < 1$ tempers the influence of the dominant columns and produces a more uniform weighting, which empirically improves CV-RMSE on spectra with sharp absorption peaks dominating the covariance. The implementation reduces to standard SIMPLS at $\gamma=1$. **Important nomenclature caveat:** R's `pls::cppls` (Liland 2009) implements *Canonical Powered PLS*, a completely different algorithm that orthogonalises blocks of $\mathbf{Y}$ before powering. The pls4all implementation matches Indahl 2005, **not** Liland 2009. The benchmark widens the parity tolerance for this method to surface the divergence as a drift rather than treat it as a bug. ### Implementation `n4m_estimators_cppls_fit` (MethodResult entry point). No widely installable Python reference; R `pls::cppls 2.8.5` is the closest installable analogue but implements Liland 2009 rather than Indahl 2005. R roxygen note (`sklearn_methods.R::cppls`): > Canonical Powered PLS — formula entry point. MATLAB header (`bindings/matlab/+pls4all/CpplsRegression.m`): ```text pls4all.CpplsRegression — Canonical Powered PLS (Indahl 2005). ``` ### Usage Every pls4all binding tab dispatches into the same C kernel; the external libraries listed at the bottom of the page are the parity references registered in `benchmarks.parity_timing.registry`. Switch tabs to read the same fit in your language. The R package now ships drop-in-compatible facades for the CRAN `pls` package (`plsr`, `pcr`, `mvr`) and for the `mdatools::pls(x, y, ...)` matrix idiom — those tabs appear only on the methods that have a meaningful equivalence. **pls4all bindings** ::::{tab-set} :class: pls4all-bindings :::{tab-item} C ABI · libn4m :sync: c :class-label: lang-c ```c /* C ABI — libn4m */ n4m_context_t* ctx = n4m_context_create(); n4m_config_t* cfg = n4m_config_create(); n4m_method_result_t* res = NULL; n4m_estimators_cppls_fit(ctx, cfg, &x_view, &y_view, /* hyperparams */, &res); /* … read coefficients / mask / scores via */ /* n4m_method_result_get_double_matrix / vector / scalar … */ n4m_method_result_destroy(res); n4m_config_destroy(cfg); n4m_context_destroy(ctx); ``` ::: :::{tab-item} Python · pls4all (raw) :sync: python-raw :class-label: lang-python ```python import pls4all from pls4all._methods import cppls_fit with pls4all.Context() as ctx, pls4all.Config() as cfg: res = cppls_fit(ctx, cfg, X, y, n_components=4) # then: res.matrix("predictions"), res.matrix("coefficients"), # res.vector("mask"), res.scalar("intercept"), … ``` ::: :::{tab-item} Python · pls4all.sklearn :sync: python-sklearn :class-label: lang-python ```python from pls4all.sklearn import CPPLSRegression mdl = CPPLSRegression(n_components=2, gamma=0.5, solver=None) mdl.fit(X, y) y_hat = mdl.predict(X_test) ``` ::: :::{tab-item} R · pls4all_method() :sync: r-dispatcher :class-label: lang-r ```r library(pls4all) # Unified low-level dispatcher (May 2026 R cleanup): res <- pls4all_method("cppls", X, y, n_components = 4L, params = list(gamma = 0.5)) # res is a named list with MethodResult arrays/scalars. # selected_indices / top_k_intervals are 1-based. ``` ::: :::{tab-item} R · pls4all (raw fn) :sync: r-raw :class-label: lang-r ```r library(pls4all) res <- cppls_fit(X, Y, n_components, gamma = 0.5) yhat <- pls4all_predict(res, X_test) ``` ::: :::{tab-item} R · pls4all (formula+S3) :sync: r-formula :class-label: lang-r ```r library(pls4all) fit <- cppls(y ~ ., data = train, ncomp = 4L) yhat <- predict(fit, newdata = test) summary(fit) ``` ::: :::{tab-item} R · `mdatools` compat :sync: r-mdatools :class-label: lang-r ```r library(pls4all) # Drop-in for `mdatools::pls(x, y, ncomp, method = "cppls")`. fit <- pls_mdatools(X, y, ncomp = 4L, method = "cppls", center = TRUE, scale = FALSE) yhat <- predict(fit, newdata = X_test, ncomp = 4L) ``` ::: :::{tab-item} MATLAB · pls4all (MEX) :sync: matlab-mex :class-label: lang-matlab ```matlab res = pls4all.cppls(X, y, 4); % see header of bindings/matlab/+pls4all/cppls.m for full % parameter surface: % res = cppls(X, Y, n_components, gamma) yhat = predict(res, Xtest); ``` ::: :::{tab-item} MATLAB · pls4all (classdef) :sync: matlab-classdef :class-label: lang-matlab ```matlab mdl = pls4all.fit("cppls", X, y, "NumComponents", 4); yhat = predict(mdl, Xtest); ``` ::: :::: **Registry parity references** 📐 :::{card} :class-card: external-refs - 📐 **`ref.r_pls`** (R · r) — `pls` 2.9.0 · strict (rmse_rel ≤ 1e-08) — R `pls::cppls` Canonical Powered PLS (Indahl, Liland & Næs 2009); default lower=upper=0.5 reduces to NIPALS PLS1 with X-only deflation for q=1. ::: ### Benchmarks Adaptive wall-clock per cell measured against [`full_matrix.csv`](../benchmarks/overview.md). Only backends that implement this method are listed; libraries without the method are omitted. **Verdict**  ·  ✓ ref / ≈ ref / ~ shape mark a reference-gate pass at strict / relaxed / qualitative tolerance  ·  ✓ bind = pls4all binding agrees with the C++ baseline  ·  ⇄ cross-check = documented by-design selector/RNG/model, noncanonical API/facade convention, or secondary oracle  ·  ✗ divergent  ·  ⚠ error  ·  — not run. The fastest backend per column is marked 🏆. **Reference gate**: strict — numeric equivalence (`rmse_rel_tol ≤ 1e-08`). Rows tagged with **📐** are the canonical parity references for this method (declared in [`parity_timing.registry`](../benchmarks/methodology.md)). C++ and external rows show reference parity; pls4all language bindings show binding parity against the C++ backend. Hover the icon for role and tolerance band. ::::{tab-set} :class: parity-tabs :::{tab-item} 1 thread :sync: threads-1
BackendParity200×50 (ms)
C++ native · libn4m
pls4all.cpp.blas+omp✓ ref 8e-161.88 ms
Python · pls4all
pls4all.python✓ bind1.87 ms🏆
pls4all.sklearn✓ 4e-151.97 ms
R · pls4all
pls4all.R✓ bind4.57 ms
pls4all.R.formula✓ bind5.65 ms
pls4all.R.mdatools⇄ +3e-026.07 ms
pls4all.R.pls⇄ +3e-0210.6 ms
R · external
📐ref.r_plssource9.91 ms
::: :::{tab-item} 3 threads :sync: threads-3
BackendParity200×50 (ms)
C++ native · libn4m
pls4all.cpp.blas+omp✓ ref 8e-161.78 ms🏆
Python · pls4all
pls4all.python✓ bind1.79 ms
pls4all.sklearn✓ 4e-151.97 ms
R · pls4all
pls4all.R✓ bind4.38 ms
pls4all.R.formula✓ bind5.49 ms
pls4all.R.mdatools⇄ +3e-026.44 ms
pls4all.R.pls⇄ +3e-0210.6 ms
R · external
📐ref.r_plssource9.85 ms
::: :::{tab-item} 10 threads :sync: threads-10
BackendParity200×50 (ms)
C++ native · libn4m
pls4all.cpp.blas+omp✓ ref 8e-161.69 ms🏆
Python · pls4all
pls4all.python✓ bind1.80 ms
pls4all.sklearn✓ 4e-151.95 ms
R · pls4all
pls4all.R✓ bind4.57 ms
pls4all.R.formula✓ bind5.38 ms
pls4all.R.mdatools⇄ +3e-026.59 ms
pls4all.R.pls⇄ +3e-0211.1 ms
R · external
📐ref.r_plssource10.5 ms
::: :::: --- _See also_: [benchmark overview](../benchmarks/overview.md) · [methods index](index.md) · [interactive dashboard](../landing/dashboard.md)