Semi-Stochastic Gradient Descent Methods

Jakub Konečný, Peter Richtárik

Introduction

Many problems in data science (e.g., machine learning, optimization and statistics) can be cast as loss minimization problems of the form

Let us now briefly review two basic approaches to solving problem (1).

where hh is a stepsize parameter and f′(xk)f^{\prime}(x_{k}) is the gradient of ff at xkx_{k}. We will refer to f′(x)f^{\prime}(x) by the name full gradient. In order to compute f′(xk)f^{\prime}(x_{k}), we need to compute the gradients of nn functions. Since nn is big, it is prohibitive to do this at every iteration.

Stochastic Gradient Descent (SGD). Unlike gradient descent, stochastic gradient descent instead picks a random ii (uniformly) and updates

Note that this strategy drastically reduces the amount of work that needs to be done in each iteration (by the factor of nn). Since

we have an unbiased estimator of the full gradient. Hence, the gradients of the component functions f1,…,fnf_{1},\dots,f_{n} will be referred to as stochastic gradients. A practical issue with SGD is that consecutive stochastic gradients may vary a lot or even point in opposite directions. This slows down the performance of SGD. On balance, however, SGD is preferable to GD in applications where low accuracy solutions are sufficient. In such cases usually only a small number of passes through the data (i.e., work equivalent to a small number of full gradient evaluations) are needed to find an acceptable xx. For this reason, SGD is extremely popular in fields such as machine learning.

In order to improve upon GD, one needs to reduce the cost of computing a gradient. In order to improve upon SGD, one has to reduce the variance of the stochastic gradients. In this paper we propose and analyze a Semi-Stochastic Gradient Descent (S2GD) method. Our method combines GD and SGD steps and reaps the benefits of both algorithms: it inherits the stability and speed of GD and at the same time retains the work-efficiency of SGD.

2 Brief literature review

Several recent papers, e.g., Richtárik & Takáč , Le Roux, Schmidt & Bach , Shalev-Shwartz & Zhang and Johnson & Zhang proposed methods which achieve such a variance-reduction effect, directly or indirectly. These methods enjoy linear convergence rates when applied to minimizing smooth strongly convex loss functions.

The method in is known as Random Coordinate Descent for Composite functions (RCDC), and can be either applied directly to (1)—in which case a single iteration requires O(n)O(n) work for a dense problem, and O(dlog⁡(1/ε))O(d\log(1/\varepsilon)) iterations in total—or to a dual version of (1), which requires O(d)O(d) work per iteration and O((n+κ)log⁡(1/ε))O((n+\kappa)\log(1/\varepsilon)) iterations in total. Application of a coordinate descent method to a dual formulation of (1) is generally referred to as Stochastic Dual Coordinate Ascent (SDCA) . The algorithm in exhibits this duality, and the method in extends the primal-dual framework to the parallel / mini-batch setting. Parallel and distributed stochastic coordinate descent methods were studied in .

Stochastic Average Gradient (SAG) is one of the first SGD-type methods, other than coordinate descent methods, which were shown to exhibit linear convergence. The method of Johnson and Zhang , called Stochastic Variance Reduced Gradient (SVRG), arises as a special case in our setting for a suboptimal choice of a single parameter of our method. The Epoch Mixed Gradient Descent (EMGD) method is similar in spirit to SVRG, but achieves a quadratic dependence on the condition number instead of a linear dependence, as is the case with SAG, SVRG and with our method.

For classical work on semi-stochastic gradient descent methods we refer We thank Zaid Harchaoui who pointed us to these papers a few days before we posted our work to arXiv. the reader to the papers of Murti and Fuchs .

3 Outline

We start in Section 2 by describing two algorithms: S2GD, which we analyze, and S2GD+, which we do not analyze, but which exhibits superior performance in practice. We then move to summarizing some of the main contributions of this paper in Section 3. Section 4 is devoted to establishing expectation and high probability complexity results for S2GD in the case of a strongly convex loss. The results are generic in that the parameters of the method are set arbitrarily. Hence, in Section 5 we study the problem of choosing the parameters optimally, with the goal of minimizing the total workload (# of processed examples) sufficient to produce a result of sufficient accuracy. In Section 6 we establish high probability complexity bounds for S2GD applied to a non-strongly convex loss function. Finally, in Section 7 we perform very encouraging numerical experiments on real and artificial problem instances. A brief conclusion can be found in Section 8.

Semi-Stochastic Gradient Descent

In this section we describe two novel algorithms: S2GD and S2GD+. We analyze the former only. The latter, however, has superior convergence properties in our experiments.

We assume throughout the paper that the functions fif_{i} are convex and LL-smooth.

(This implies that the gradient of ff is Lipschitz with constant LL, and hence ff satisfies the same inequality.)

In one part of the paper (Section 4) we also make the following additional assumption:

Algorithm 1 (S2GD) depends on three parameters: stepsize hh, constant mm limiting the number of stochastic gradients computed in a single epoch, and a ν∈[0,μ]\nu\in[0,\mu], where μ\mu is the strong convexity constant of ff. In practice, ν\nu would be a known lower bound on μ\mu. Note that the algorithm works also without any knowledge of the strong convexity parameter — the case of ν=0\nu=0.

The method has an outer loop, indexed by epoch counter jj, and an inner loop, indexed by tt. In each epoch jj, the method first computes gjg_{j}—the full gradient of ff at xjx_{j}. Subsequently, the method produces a random number tj∈[1,m]t_{j}\in[1,m] of steps, following a geometric law, where

with only two stochastic gradients computed in each step It is possible to get away with computinge only a single stochastic gradient per inner iteration, namely fi′(yj,t)f_{i}^{\prime}(y_{j,t}), at the cost of having to store in memory fi′(xj)f^{\prime}_{i}(x_{j}) for i=1,2,…,ni=1,2,\dots,n. This, however, will be impractical for big nn.. For each t=0,…,tj−1t=0,\dots,t_{j}-1, the stochastic gradient fi′(xj)f^{\prime}_{i}(x_{j}) is subtracted from gjg_{j}, and fi′(yj,t−1)f^{\prime}_{i}(y_{j,t-1}) is added to gjg_{j}, which ensures that, one has

where the expectation is with respect to the random variable ii.

Hence, the algorithm is stochastic gradient descent – albeit executed in a nonstandard way (compared to the traditional implementation described in the introduction).

Note that for all jj, the expected number of iterations of the inner loop, E(tj)\mathbf{E}(t_{j}), is equal to

Also note that ξ∈[m+12,m)\xi\in[\tfrac{m+1}{2},m), with the lower bound attained for ν=0\nu=0, and the upper bound for νh→1\nu h\to 1.

2 S2GD+

We also implement Algorithm 2, which we call S2GD+. In our experiments, the performance of this method is superior to all methods we tested, including S2GD. However, we do not analyze the complexity of this method and leave this as an open problem.

In brief, S2GD+ starts by running SGD for 1 epoch (1 pass over the data) and then switches to a variant of S2GD in which the number of the inner iterations, tjt_{j}, is not random, but fixed to be nn or a small multiple of nn.

The motivation for this method is the following. It is common knowledge that SGD is able to progress much more in one pass over the data than GD (where this would correspond to a single gradient step). However, the very first step of S2GD is the computation of the full gradient of ff. Hence, by starting with a single pass over data using SGD and then switching to S2GD, we obtain a superior method in practice. Using a single pass of SGD as an initialization strategy was already considered in . However, the authors claim that their implementation of vanilla SAG did not benefit from it. S2GD does benefit from such an initialization due to it starting, in theory, with a (heavy) full gradient computation.

Summary of Results

In this section we summarize some of the main results and contributions of this work.

Complexity for strongly convex ff. If ff is strongly convex, S2GD needs

work (measured as the total number of evaluations of the stochastic gradient, accounting for the full gradient evaluations as well) to output an ε\varepsilon-approximate solution (in expectation or in high probability), where κ=L/μ\kappa=L/\mu is the condition number. This is achieved by running S2GD with stepsize h=O(1/L)h=O(1/L), j=O(log⁡(1/ε))j=O(\log(1/\varepsilon)) epochs (this is also equal to the number of full gradient evaluations) and m=O(κ)m=O(\kappa) (this is also roughly equal to the number of stochastic gradient evaluations in a single epoch). The complexity results are stated in detail in Sections 4 and 5 (see Theorems 10, 19 and 6; see also (27) and (26)).

Comparison with existing results. This complexity result (6) matches the best-known results obtained for strongly convex losses in recent work such as , and . Our treatment is most closely related to , and contains their method (SVRG) as a special case. However, our complexity results have better constants, which has a discernable effect in practice. In Table 1 we compare our results in the strongly convex case with other existing results for different algorithms.

We should note that the rate of convergence of Nesterov’s algorithm is a deterministic result. EMGD and S2GD results hold with high probability. The remaining results hold in expectation. Complexity results for stochastic coordinate descent methods are also typically analyzed in the high probability regime .

Complexity for convex ff. If ff is not strongly convex, then we propose that S2GD be applied to a perturbed version of the problem, with strong convexity constant μ=O(L/ε)\mu=O(L/\varepsilon). An ε\varepsilon-accurate solution of the original problem is recovered with arbitrarily high probability (see Theorem 8 in Section 6). The total work in this case is

Optimal parameters. We derive formulas for optimal parameters of the method which (approximately) minimize the total workload, measured in the number of stochastic gradients computed (counting a single full gradient evaluation as nn evaluations of the stochastic gradient). In particular, we show that the method should be run for O(log⁡(1/ε))O(\log(1/\varepsilon)) epochs, with stepsize h=O(1/L)h=O(1/L) and m=O(κ)m=O(\kappa). No such results were derived for SVRG in .

One epoch. In the case when S2GD is run for 1 epoch only, effectively limiting the number of full gradient evaluations to 1, we show that S2GD with ν=μ\nu=\mu needs

work only (see Table 2). This compares favorably with the optimal complexity in the ν=0\nu=0 case (which reduces to SVRG), where the work needed is

For two epochs one could just say that we need ε\sqrt{\varepsilon} decrease in iach epoch, thus having complexity of O(n+(κ/ε)log⁡(1/ε))O(n+(\kappa/\sqrt{\varepsilon})\log(1/\sqrt{\varepsilon})). This is already better than general rate of SGD (O(1/ε)).(O(1/\varepsilon)).

Special cases. GD and SVRG arise as special cases of S2GD, for m=1m=1 and ν=0\nu=0, respectively. While S2GD reduces to GD for m=1m=1, our analysis does not say anything meaningful in the m=1m=1 case - it is too coarse to cover this case. This is also the reason behind the empty space in the “Complexity” box column for GD in Table 2.

Low memory requirements. Note that SDCA and SAG, unlike SVRG and S2GD, need to store all gradients fi′f^{\prime}_{i} (or dual variables) throughout the iterative process. While this may not be a problem for a modest sized optimization task, this requirement makes such methods less suitable for problems with very large nn.

S2GD+. We propose a “boosted” version of S2GD, called S2GD+, which we do not analyze. In our experiments, however, it performs vastly superior to all other methods we tested, including GD, SGD, SAG and S2GD. S2GD alone is better than both GD and SGD if a highly accurate solution is required. The performance of S2GD and SAG is roughly comparable, even though in our experiments S2GD turned to have an edge.

Complexity Analysis: Strongly Convex Loss

be the σ\sigma-algebra generated by the relevant history of S2GD. We first isolate an auxiliary result.

Consider the S2GD algorithm. For any fixed epoch number jj, the following identity holds:

By the tower property of expectations and the definition of xj+1x_{j+1} in the algorithm, we obtain

We now state and prove the main result of this section.

Let Assumptions 1 and 2 be satisfied. Consider the S2GD algorithm applied to solving problem (1). Choose 0≤ν≤μ0\leq\nu\leq\mu, 0<h<12L0<h<\frac{1}{2L}, and let mm be sufficiently large so that

Then we have the following convergence in expectation:

Before we proceed to proving the theorem, note that in the special case with ν=0\nu=0, we recover the result of Johnson and Zhang (with a minor improvement in the second term of cc where LL is replaced by L−μL-\mu), namely

If we set ν=μ\nu=\mu, then cc can be written in the form (see (4))

Clearly, the latter cc is a major improvement on the former one. We shall elaborate on this further later.

It is well-known [7, Theorem 2.1.5] that since the functions fif_{i} are LL-smooth, they necessarily satisfy the following inequality:

By summing these inequalities for i=1,…,ni=1,\dots,n, and using f′(x∗)=0,f^{\prime}(x_{*})=0, we get

Let Gj,t=defgj+fi′(yj,t−1)−fi′(xj)G_{j,t}\overset{\text{def}}{=}g_{j}+f_{i}^{\prime}(y_{j,t-1})-f^{\prime}_{i}(x_{j}) be the direction of update at jth{j}^{th} iteration in the outer loop and ttht^{th} iteration in the inner loop. Taking expectation with respect to ii, conditioned on the σ\sigma-algebra Fj,t−1\mathcal{F}_{j,t-1} (7), we obtain For simplicity, we supress the E(⋅  ∣  Fj,t−1)\mathbf{E}(\cdot\;|\;\mathcal{F}_{j,t-1}) notation here.

Above we have used the bound ∥x′+x′′∥2≤2∥x′∥2+2∥x′′∥2\|x^{\prime}+x^{\prime\prime}\|^{2}\leq 2\|x^{\prime}\|^{2}+2\|x^{\prime\prime}\|^{2} and the fact that

We now study the expected distance to the optimal solution (a standard approach in the analysis of gradient methods):

By rearranging the terms in (16) and taking expectation over the σ\sigma-algebra Fj,t−1\mathcal{F}_{j,t-1}, we get the following inequality:

Finally, we can analyze what happens after one iteration of the outer loop of S2GD, i.e., between two computations of the full gradient. By summing up inequalities (17) for t=1,…,mt=1,\dots,m, with inequality tt multiplied by (1−νh)m−t(1-\nu h)^{m-t}, we get the left-hand side

Since LHS≤RHSLHS\leq RHS, we finally conclude with

Since we have established linear convergence of expected values, a high probability result can be obtained in a straightforward way using Markov inequality.

Consider the setting of Theorem 4. Then, for any 0<ρ<10<\rho<1, 0<ε<10<\varepsilon<1 and

This follows directly from Markov inequality and Theorem 10:

This result will be also useful when treating the non-strongly convex case.

Optimal Choice of Parameters

The goal of this section is to provide insight into the choice of parameters of S2GD; that is, the number of epochs (equivalently, full gradient evaluations) jj, the maximal number of steps in each epoch mm, and the stepsize hh. The remaining parameters (L,μ,nL,\mu,n) are inherent in the problem and we will hence treat them in this section as given.

In particular, ideally we wish to find parameters jj, mm and hh solving the following optimization problem:

In view of (10), accuracy constraint (21) is satisfied if cc (which depends on hh and mm) and jj satisfy

We therefore instead consider the parameter fine-tuning problem

In the following we (approximately) solve this problem in two steps. First, we fix jj and find (nearly) optimal h=h(j)h=h(j) and m=m(j)m=m(j). The problem reduces to minimizing mm subject to c≤ε1/jc\leq\varepsilon^{1/{j}} by fine-tuning hh. While in the ν=0\nu=0 case it is possible to obtain closed form solution, this is not possible for ν>μ\nu>\mu.

However, it is still possible to obtain a good formula for h(j)h(j) leading to expression for good m(j)m(j) which depends on ε\varepsilon in the correct way. We then plug the formula for m(j)m(j) obtained this way back into (23), and study the quantity W(j,m(j),h(j))=j(n+2m(j)){\cal W}(j,m(j),h(j))=j(n+2m(j)) as a function of jj, over which we optimize optimize at the end.

Fix the number of epochs j≥1j\geq 1, error tolerance 0<ε<10<\varepsilon<1, and let Δ=ε1/j\Delta=\varepsilon^{1/j}. If we run S2GD with the stepsize

then E(f(xj)−f(x∗))≤ε(f(x0)−f(x∗)).\mathbf{E}(f(x_{j})-f(x_{*}))\leq\varepsilon(f(x_{0})-f(x_{*})).

In particular, if we choose j∗=⌈log⁡(1/ε)⌉{j}^{*}=\lceil\log(1/\varepsilon)\rceil, then 1Δ≤exp⁡(1)\frac{1}{\Delta}\leq\exp(1), and hence m(j∗)=O(κ)m({j}^{*})=O(\kappa), leading to the workload

We only need to show that c≤Δc\leq\Delta, where cc is given by (12) for ν=μ\nu=\mu and by (11) for ν=0\nu=0. We denote the two summands in expressions for cc as c1c_{1} and c2c_{2}. We choose the hh and mm so that both c1c_{1} and c2c_{2} are smaller than Δ/2\Delta/2, resulting in c1+c2=c≤Δc_{1}+c_{2}=c\leq\Delta.

and hence it only remains to verify that c1=c−c2≤Δ2c_{1}=c-c_{2}\leq\frac{\Delta}{2}. In the ν=0\nu=0 case, m(j)m(j) is chosen so that c−c2=Δ2c-c_{2}=\frac{\Delta}{2}. In the ν=μ\nu=\mu case, c−c2=Δ2c-c_{2}=\frac{\Delta}{2} holds for m=log⁡(2Δ+2κ−1κ−1)/log⁡(11−H)m=\log\left(\frac{2}{\Delta}+\frac{2\kappa-1}{\kappa-1}\right)/\log\left(\frac{1}{1-H}\right), where H=(4(κ−1)Δ+2κ)−1H=\left(\frac{4(\kappa-1)}{\Delta}+2\kappa\right)^{-1}. We only need to observe that cc decreases as mm increases, and apply the inequality log⁡(11−H)≥H\log\left(\frac{1}{1-H}\right)\geq H.

Workload. Notice that for the choice of parameters j∗j^{*}, h=h(j∗)h=h(j^{*}), m=m(j∗)m=m(j^{*}) and any ν∈[0,μ]\nu\in[0,\mu], the method needs log⁡(1/ε)\log(1/\varepsilon) computations of the full gradient (note this is independent of κ\kappa), and O(κlog⁡(1/ε))O(\kappa\log(1/\varepsilon)) computations of the stochastic gradient. This result, and special cases thereof, are summarized in Table 2.

Simpler formulas for mm. If κ≥2\kappa\geq 2, we can instead of (25) use the following (slightly worse but) simpler expressions for m(j)m(j), obtained from (25) by using the bounds 1≤κ−11\leq\kappa-1, κ−1≤κ\kappa-1\leq\kappa and Δ<1\Delta<1 in appropriate places (e.g., 8κΔ<8κΔ2\tfrac{8\kappa}{\Delta}<\tfrac{8\kappa}{\Delta^{2}}, κκ−1≤2<2Δ2\tfrac{\kappa}{\kappa-1}\leq 2<\tfrac{2}{\Delta^{2}}):

Optimal stepsize in the ν=0\nu=0 case. Theorem 6 does not claim to have solved problem (23); the problem in general does not have a closed form solution. However, in the ν=0\nu=0 case a closed-form formula can easily be obtained:

Indeed, for fixed jj, (23) is equivalent to finding hh that minimizes mm subject to the constraint c≤Δc\leq\Delta. In view of (11), this is equivalent to searching for h>0h>0 maximizing the quadratic h→h(Δ−2(ΔL+L−μ)h)h\to h(\Delta-2(\Delta L+L-\mu)h), which leads to (28).

Note that both the stepsize h(j)h(j) and the resulting m(j)m(j) are slightly larger in Theorem 6 than in (28). This is because in the theorem the stepsize was for simplicity chosen to satisfy c2=Δ2c_{2}=\frac{\Delta}{2}, and hence is (slightly) suboptimal. Nevertheless, the dependence of m(j)m(j) on Δ\Delta is of the correct (optimal) order in both cases. That is, m(j)=O(κΔlog⁡(1Δ))m(j)=O\left(\tfrac{\kappa}{\Delta}\log(\tfrac{1}{\Delta})\right) for ν=μ\nu=\mu and m(j)=O(κΔ2)m(j)=O\left(\tfrac{\kappa}{\Delta^{2}}\right) for ν=0\nu=0.

Stepsize choice. In cases when one does not have a good estimate of the strong convexity constant μ\mu to determine the stepsize via (24), one may choose suboptimal stepsize that does not depend on μ\mu and derive similar results to those above. For instance, one may choose h=Δ6Lh=\frac{\Delta}{6L}.

In Table 3 we provide comparison of work needed for small values of jj, and different values of κ\kappa and ε.\varepsilon. Note, for instance, that for any problem with n=109n=10^{9} and κ=103\kappa=10^{3}, S2GD outputs a highly accurate solution (ε=10−6\varepsilon=10^{-6}) in the amount of work equivalent to 2.122.12 evaluations of the full gradient of ff!

Complexity Analysis: Convex Loss

If ff is convex but not strongly convex, we define f^i(x)=deffi(x)+μ2∥x−x0∥2\hat{f}_{i}(x)\overset{\text{def}}{=}f_{i}(x)+\tfrac{\mu}{2}\|x-x_{0}\|^{2}, for small enough μ>0\mu>0 (we shall see below how the choice of μ\mu affects the results), and consider the perturbed problem

Note that f^\hat{f} is μ\mu-strongly convex and (L+μ)(L+\mu)-smooth. In particular, the theory developed in the previous section applies. We propose that S2GD be instead applied to the perturbed problem, and show that an approximate solution of (29) is also an approximate solution of (1) (we will assume that this problem has a minimizer).

Let x^∗\hat{x}_{*} be the (necessarily unique) solution of the perturbed problem (29). The following result describes an important connection between the original problem and the perturbed problem.

The statement is almost identical to Lemma 9 in ; its proof follows the same steps with only minor adjustments. ∎

We are now ready to establish a complexity result for non-strongly convex losses.

Let Assumption 1 be satisfied. Choose μ>0\mu>0, 0≤ν≤μ0\leq\nu\leq\mu, stepsize 0<h<12(L+μ)0<h<\tfrac{1}{2(L+\mu)}, and let mm be sufficiently large so that

In particular, if we choose μ=ϵ<L\mu=\epsilon<L and parameters j∗j^{*}, h(j∗)h(j^{*}), m(j∗)m(j^{*}) as in Theorem 6, the amount of work performed by S2GD to guarantee (33) is

which consists of O(1ε)O(\tfrac{1}{\varepsilon}) full gradient evaluations and O(Lϵlog⁡(1ε))O(\tfrac{L}{\epsilon}\log(\tfrac{1}{\varepsilon})) stochastic gradient evaluations.

where the first inequality follows from f≤f^f\leq\hat{f}, and the second one from optimality of x∗x_{*}. Hence, by first applying Lemma 7 with x^=x^j\hat{x}=\hat{x}_{j} and δ=ε(f(x0)−f(x∗))\delta=\varepsilon(f(x_{0})-f(x_{*})), and then Theorem 19, with c←c^c\leftarrow\hat{c}, f←f^f\leftarrow\hat{f}, x0←x^0x_{0}\leftarrow\hat{x}_{0}, x∗←x^∗x_{*}\leftarrow\hat{x}_{*}, we obtain

The second statement follows directly from the second part of Theorem 6 and the fact that the condition number of the perturbed problem is κ=L+ϵϵ≤2Lϵ\kappa=\tfrac{L+\epsilon}{\epsilon}\leq\tfrac{2L}{\epsilon}. ∎

Numerical Experiments

In this section we conduct computational experiments to illustrate some aspects of the performance of our algorithm. In Section 7.1 we consider the least squares problem with synthetic data to compare the practical performance and the theoretical bound on convergence in expectations. We demonstrate that for both SVRG and S2GD, the practical rate is substantially better than the theoretical one. In Section 7.2 we explain an efficient way to implement the S2GD algorithm for sparse datasets. In Section 7.3 we compare the S2GD algorithm on several real datasets with other algorithms suitable for this task. We also provide efficient implementation of the algorithm for the case of logistic regression in the MLOSS repository http://mloss.org/software/view/556/.

Figure 1 presents a comparison of the theoretical rate and practical performance on a larger problem with artificial data, with a condition number we can control (and choose it to be poor). In particular, we consider the L2-regularized least squares with

We consider an instance with n=100,000n=100,000, d=1,000d=1,000 and κ=10,000.\kappa=10,000. We run the algorithm with both parameters ν=λ\nu=\lambda (our best estimate of μ\mu) and ν=0\nu=0. Recall that the latter choice leads to the SVRG method of Johnson and Zhang . We chose parameters mm and hh as a (numerical) solution of the work-minimization problem (20), obtaining m=261,063m=261,063 and h=1/11.4Lh=1/11.4L for ν=λ\nu=\lambda and m=426,660m=426,660 and h=1/12.7Lh=1/12.7L for ν=0\nu=0. The practical performance is obtained after a single run of the S2GD algorithm.

The figure demonstrates linear convergence of S2GD in practice, with the convergence rate being significantly better than the already strong theoretical result. Recall that the bound is on the expected function values. We can observe a rather strong convergence to machine precision in work equivalent to evaluating the full gradient only 4040 times. Needless to say, neither SGD nor GD have such speed. Our method is also an improvement over , both in theory and practice.

2 Implementation for sparse data

In our sparse implementation of Algorithm 1, described in this section and formally stated as Algorithm 3, we make the following structural assumption:

In this case, fi′(x)=ϕi′(aiTx)aif^{\prime}_{i}(x)=\phi_{i}^{\prime}(a_{i}^{T}x)a_{i}.

This is the structure in many cases of interest, including linear or logistic regression.

A natural question one might want to ask is whether S2GD can be implemented efficiently for sparse data.

Let us first take a brief detour and look at SGD, which performs iterations of the type:

Let ωi\omega_{i} be the number of nonzero features in example aia_{i}, i.e., ωi=def∥ai∥0≤d\omega_{i}\overset{\text{def}}{=}\|a_{i}\|_{0}\leq d. Assuming that the computation of the derivative of the univariate function ϕi\phi_{i} takes O(1)O(1) amount of work, the computation of ∇fi(x)\nabla f_{i}(x) will take O(ωi)O(\omega_{i}) work. Hence, the update step (35) will cost O(ωi)O(\omega_{i}), too, which means the method can naturally speed up its iterations on sparse data.

The situation is not as simple with S2GD, which for loss functions of the type described in Assumption 9 performs inner iterations as follows:

Indeed, note that gj=f′(xj)g_{j}=f^{\prime}(x_{j}) is in general be fully dense even for sparse data {ai}\{a_{i}\}. As a consequence, the update in (36) might be as costly as dd operations, irrespective of the sparsity level ωi\omega_{i} of the active example aia_{i}. However, we can use the following “lazy/delayed” update trick. We split the update to the yy vector into two parts: immediate, and delayed. Assume index i=iti=i_{t} was chosen at inner iteration tt. We immediately perform the update

which costs O(ait)O(a_{i_{t}}). Note that we have not computed the yj,t+1y_{j,t+1}. However, we “know” that

without having to actually compute the difference. At the next iteration, we are supposed to perform update (36) for i=it+1i=i_{t+1}:

as we never computed yj,t+1y_{j,t+1}. However, here lies the trick: as ait+1a_{i_{t+1}} is sparse, we only need to know those coordinates ss of yj,t+1y_{j,t+1} for which ait+1(s)a_{i_{t+1}}^{(s)} is nonzero. So, just before we compute the (sparse part of) of the update (37), we perform the update

for coordinates ss for which ait+1(s)a_{i_{t+1}}^{(s)} is nonzero. This way we know that the inner product appearing in (38) is computed correctly (despite the fact that yj,t+1y_{j,t+1} potentially is not!). In turn, this means that we can compute the sparse part of the update in (37).

We need to remember, for each coordinate ss, the last iteration counter tt for which ait(s)≠0a_{i_{t}}^{(s)}\neq 0. This way we will know how many times did we “forget” to apply the dense update −hgj(s)-hg_{j}^{(s)}. We do it in a just-in-time fashion, just before it is needed.

3 Comparison with other methods

The S2GD algorithm can be applied to several classes of problems. We perform experiments on an important and in many applications used L2-regularized logistic regression for binary classification on several datasets. The functions fif_{i} in this case are:

where lil_{i} is the label of ithi^{th} training exapmle aia_{i}. In our experiments we set the regularization parameter λ=O(1/n)\lambda=O(1/n) so that the condition number κ=O(n)\kappa=O(n), which is about the most ill-conditioned problem used in practice. We added a (regularized) bias term to all datasets.

All the datasets we used, listed in Table 4, are freely available Available at http://www.csie.ntu.edu.tw/∼\simcjlin/libsvmtools/datasets/. benchmark binary classification datasets.

In the experiment, we compared the following algorithms:

SGD: Stochastic Gradient Descent. After various experiments, we decided to use a variant with constant step-size that gave the best practical performance in hindsight.

L-BFGS: A publicly-available limited-memory quasi-Newton method that is suitable for broader classes of problems. We used a popular implementation by Mark Schmidt. http://www.di.ens.fr/∼\simmschmidt/Software/minFunc.html

SAG: Stochastic Average Gradient . This is the most important method to compare to, as it also achieves linear convergence using only stochastic gradient evaluations. Although the methods has been analysed for stepsize h=1/16Lh=1/16L, we experimented with various stepsizes and chose the one that gave the best performance for each problem individually.

S2GDcon: The S2GD algorithm with conservative stepsize choice, i.e., following the theory. We set m=O(κ)m=O(\kappa) and h=1/10Lh=1/10L, which is approximately the value you would get from Equation (24)

S2GD: The S2GD algorithm, with stepsize that gave the best performance in hindsight.

Note that SAG needs to store nn gradients in memory in order to run. In case of relatively simple functions, one can store only nn scalars, as the gradient of fif_{i} is always a multiple of aia_{i}. If we are comparing with SAG, we are implicitly assuming that our memory limitations allow us to do so. Although not included in Algorithm 1, we could also store these gradients we used to compute the full gradient, which would mean we would only have to compute a single stochastic gradient per inner iteration (instead of two).

We plot the results of these methods, as applied to various different, in the Figure 2 for first 15-30 passes through the data (i.e., amount of work work equivalent to 15-30 full gradient evaluations).

There are several remarks we would like to make. First, our experiments confirm the insight from that for this types of problems, reduced-variance methods consistently exhibit substantially better performance than the popular L-BFGS algorithm.

The performance gap between S2GDcon and S2GD differs from dataset to dataset. A possible explanation for this can be found in an extension of SVRG to proximal setting , released after the first version of this paper was put onto arXiv (i.e., after December 2013) . Instead Assumption 1, where all loss functions are assumed to be associated with the same constant LL, the authors of instead assume that each loss function fif_{i} has its own constant LiL_{i}. Subsequently, they sample proportionally to these quantities as opposed to the uniform sampling. In our case, L=max⁡iLiL=\max_{i}L_{i}. This importance sampling has an impact on the convergence: one gets dependence on the average of the quantities LiL_{i} and not in their maximum.

The number of passes through data seems a reasonable way to compare performance, but some algorithms could need more time to do the same amount of passes through data than others. In this sense, S2GD should be in fact faster than SAG due to the following property. While SAG updates the test point after each evaluation of a stochastic gradient, S2GD does not always make the update — during the evaluation of the full gradient. This claim is supported by computational evidence: SAG needed about 10-30% more time than S2GD to do the same amount of passes through data.

Finally, in Table 5 we provide the time it took the algorithm to produce these plots on a desktop computer with Intel Core i7 3610QM processor, with 2 ×\times 4GB DDR3 1600 MHz memory. The number for L-BFGS at the url dataset is not representative, as the algorithm needed extra memory, which slightly exceeded the memory limit of our computer.

4 Boosted variants of S2GD and SAG

In this section we study the practical performance of boosted methods, namely S2GD+ (Algorithm 2) and variant of SAG suggested by its authors [12, Section 4.2].

SAG+ is a simple modification of SAG, where one does not divide the sum of the stochastic gradients by nn, but by the number of training examples seen during the run of the algorithm, which has the effect of producing larger steps at the beginning. The authors claim that this method performed better in practice than a hybrid SG/SAG algorithm.

We have observed that, in practice, starting SAG from a point close to the optimum, leads to an initial “away jump“. Eventually, the method exhibits linear convergence. In contrast, S2GD converges linearly from the start, regardless of the starting position.

Figure 3 shows that S2GD+ consistently improves over S2GD, while SAG+ does not improve always: sometimes it performs essentially the same as SAG. Although S2GD+ is overall a superior algorithm, one should note that this comes at the cost of having to choose stepsize parameter for SGD initialization. If one chooses these parameters poorly, then S2GD+ could perform worse than S2GD. The other three algorithms can work well without any parameter tuning.

Conclusion

We have developed a new semi-stochastic gradient descent method (S2GD) and analyzed its complexity for smooth convex and strongly convex loss functions. Our methods need O((κ/n)log⁡(1/ε))O((\kappa/n)\log(1/\varepsilon)) work only, measured in units equivalent to the evaluation of the full gradient of the loss function, where κ=L/μ\kappa=L/\mu if the loss is LL-smooth and μ\mu-strongly convex, and κ≤2L/ε\kappa\leq 2L/\varepsilon if the loss is merely LL-smooth.

Our results in the strongly convex case match or improve on a few very recent results, while at the same time generalizing and simplifying the analysis. Additionally, we proposed S2GD+ —a method which equips S2GD with an SGD pre-processing step—which in our experiments exhibits superior performance to all methods we tested. We leave the analysis of this method as an open problem.

References