SCFGP

Regression Model: Sparsely Correlated Fourier Features Based Gaussian Process


License
BSD-3-Clause
Install
pip install SCFGP==0.1.0

Documentation

SCFGP

SCFGP is a proposed improvement of Sparse Spectrum Gaussian Process (SPGP), which is a new branch of method to speed up Gaussian process model taking advantage of Fourier features. Recall that using Gaussian processes for machine learning is a state-of-the-art technique that originate from and popularize by Carl Edward Rasmussen and Christopher K. I. Williams.

Based on minimization of the marginal likelihood, SCFGP selects a set of vectors to obtain a Gramian matrix, which is treated as the frequency matrix for later computation of Fourier features. This procedure indeed can be viewed as constructing sparsely correlated Fourier features.

Note that the Fourier features are identically and independently distributed in SPGP, therefore the size of optimization parameters is proportional to the number of Fourier features times the number of dimension. This is undoubtedly an unfavorable property, since the model is likely to stick in local minima and becomes very unstable when dealing with very high dimensional data, such as images, speech signals, text, etc.

The formulation of SCFGP is briefly described in this sheet: (Derivation will be included in the future)

SCFGP Formulas

SCFGP is implemented in python using Theano and originally designed by Max W. Y. Lam (maxingaussian@gmail.com).

Highlights of SCFGP

  • SCFGP optimizes the Fourier features so as to "learn" a tailmade covariance matrix from the data. This removes the necessity of deciding which kernel function to use in different problems.

  • SCFGP implements a variety of formulation to transform the optimized Fourier features to covariance matrix, including the typical sin-cos concatenation introduced by Miguel, and the generalized approach described by Yarin.

  • SCFGP uses low-rank frequency matrix for sparse approximation of Fourier features. It is intended to show that low-rank frequency matrix is able to lower the computational burden in each step of optimization, and also render faster convergence and a stabler result.

  • Compared with other state-of-the-art regressors, SCFGP usually gives the most accurate prediction on the benchmark datasets of regression.

Installation

SCFGP

To install SCFGP, use pip:

$ pip install SCFGP

Or clone this repo:

$ git clone https://github.com/MaxInGaussian/SCFGP.git
$ python setup.py install

Dependencies

Theano

Theano is used due to its nice and simple syntax to set up the tedious formulas in SCFGP, and
its capability of computing automatic differentiation.

To install Theano, see this page:

http://deeplearning.net/software/theano/install.html

scikit-learn (only used in the experiments)

To install scikit-learn, see this page:

https://github.com/scikit-learn/scikit-learn

Try SCFGP with Only 3 Lines of Code

from SCFGP import *
# <>: necessary inputs, {}: optional inputs
model = SCFGP(rank=<rank_of_frequency_matrix>,
              feature_size=<number_of_Fourier_features>,
              fftype={feature_type},
              msg={print_message_or_not})
model.fit(X_train, y_train, {X_test}, {y_test})
predict_mean, predict_std = model.predict(X_test, {y_test})

Analyze Training Process on Real Time

Training on High-dimensional Inputs (Boston Housing)

model.fit(X_train, y_train, X_test, y_test, plot_training=True)

PlotTraining

Training on One-dimensional Inputs (Mauna Loa Atmospheric CO2)

model.fit(X_train, y_train, X_test, y_test, plot_1d_function=True)

Plot1DFunction

Performance of SCFGP on Benchmark Datasets

Benchmark Dataset Number of Attributes Size of Training Data Size of Testing Data
Bostion Housing 13 400 106
Abalone 10 3133 1044
Kin8nm 10 5000 3192

Predict Boston Housing Prices

Regression Model MAE MSE RMSE NMSE MNLP Training Time (s)
SCFGP 1.3398 3.1828 1.7841 0.0405 2.0106 12.8740
Boosting N/A 10.7 N/A N/A N/A N/A
MARK-L N/A 12.4 N/A N/A N/A 6.0
PS-SVR N/A 7.887 N/A 0.0833 N/A N/A
spLGP 1.73 N/A N/A N/A N/A N/A
Student-t GP N/A N/A N/A 0.0824 N/A N/A

P.S. SCFGP's performance refers to this model:

boston_housing_best_model = SCFGP()
boston_housing_best_model.load("experiments/boston_housing/best_model.pkl")

Predict Age of Abalone

State-Of-The-Art Model MAE MSE RMSE NMSE MNLP Training Time (s)
SCFGP 1.4113 3.8153 1.9533 0.3715 2.0916 9.5621
MARK-L N/A 4.65 N/A N/A N/A 57.0

P.S. SCFGP's performance refers to this model:

abalone_best_model = SCFGP()
abalone_best_model.load("experiments/abalone/best_model.pkl")

Predict Kinematics of 8-link Robot Arm

State-Of-The-Art Model MAE MSE RMSE NMSE MNLP Training Time (s)
SCFGP 0.0561 0.0052 0.0718 0.0741 -1.2170 355.6762

P.S. SCFGP's performance refers to this model:

kin8nm_best_model = SCFGP()
kin8nm_best_model.load("experiments/kin8nm/best_model.pkl")

Performance of SCFGP v.s. Number of Fourier features

Bostion Housing

BostonHousingMAE BostonHousingMSE BostonHousingRMSE BostonHousingNMSE BostonHousingMNLP BostonHousingTime

Abalone

AbaloneMAE AbaloneMSE AbaloneRMSE AbaloneNMSE AbaloneMNLP AbaloneTime

Kin8nm

Kin8nmMAE Kin8nmMSE Kin8nmRMSE Kin8nmNMSE Kin8nmMNLP Kin8nmTime

Training time of SCFGP is not quite sensitive to the size of training data.
On the contrary, it is to a large extent dependent on the number of Fourier features.

License

Copyright (c) 2016, Max W. Y. Lam All rights reserved.

Redistribution and use in source and binary forms, with or without modification, are permitted provided that the following conditions are met:

  1. Redistributions of source code must retain the above copyright notice, this list of conditions and the following disclaimer.

  2. Redistributions in binary form must reproduce the above copyright notice, this list of conditions and the following disclaimer in the documentation and/or other materials provided with the distribution.

  3. Neither the name of the copyright holder nor the names of its contributors may be used to endorse or promote products derived from this software without specific prior written permission.

THIS SOFTWARE IS PROVIDED BY THE COPYRIGHT HOLDERS AND CONTRIBUTORS "AS IS" AND ANY EXPRESS OR IMPLIED WARRANTIES, INCLUDING, BUT NOT LIMITED TO, THE IMPLIED WARRANTIES OF MERCHANTABILITY AND FITNESS FOR A PARTICULAR PURPOSE ARE DISCLAIMED. IN NO EVENT SHALL THE COPYRIGHT HOLDER OR CONTRIBUTORS BE LIABLE FOR ANY DIRECT, INDIRECT, INCIDENTAL, SPECIAL, EXEMPLARY, OR CONSEQUENTIAL DAMAGES (INCLUDING, BUT NOT LIMITED TO, PROCUREMENT OF SUBSTITUTE GOODS OR SERVICES; LOSS OF USE, DATA, OR PROFITS; OR BUSINESS INTERRUPTION) HOWEVER CAUSED AND ON ANY THEORY OF LIABILITY, WHETHER IN CONTRACT, STRICT LIABILITY, OR TORT (INCLUDING NEGLIGENCE OR OTHERWISE) ARISING IN ANY WAY OUT OF THE USE OF THIS SOFTWARE, EVEN IF ADVISED OF THE POSSIBILITY OF SUCH DAMAGE.