Computing dense subgraphs with semidefinite programming · Finding a densest k-subgraph ? Difficult...
Transcript of Computing dense subgraphs with semidefinite programming · Finding a densest k-subgraph ? Difficult...
Computing dense subgraphs withsemidefinite programming
Jerome MALICK∗ Frederic ROUPIN∗∗
∗CNRS, Lab. Jean Kuntzmann, Grenoble
∗∗LIPN-CNRS, University Paris XIII
Optimization 2011, Lisbon – July 2011
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A combinatorial optimization problem
Find a subgraph of k vertices with maximum number of edges
Example: graph with n = 8 vertices, best subgraph with k = 4 ?
The densest-subgraph problem:
generalization of max-clique
(difficult) particular case of quadratic knapsack
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A combinatorial optimization problem
Find a subgraph of k vertices with maximum number of edges
Example: graph with n = 8 vertices, best subgraph with k = 4 ?
The densest-subgraph problem:
generalization of max-clique
(difficult) particular case of quadratic knapsack
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Finding a densest k-subgraph ?
Difficult problem (NP-hard and more - see e.g. Khot ’05)
Solving to optimality ? Few methods:
– using linear programming (Ekrut ’90)– using reformulation techniques (Pisinger ’06)– using quadratic programming (Billionnet-Elloumi-Plateau ’09)
Compute dense subgraphs for unrestricted graphs with n 6 100
Rem: SDP bounds are very tight - but expensive (Roupin ’04)
Question: use this to be competitive with best methods ?
Objective of our work:1 to study new SDP bounds - that trade tightness for cpu time,
while keeping SDP-like quality !
2 to use them within branch-and-bound for computing densestk-subgraphs
3 to compare with the best: Billionnet-Elloumi-Plateau ’09
4
Finding a densest k-subgraph ?
Difficult problem (NP-hard and more - see e.g. Khot ’05)
Solving to optimality ? Few methods:
– using linear programming (Ekrut ’90)– using reformulation techniques (Pisinger ’06)– using quadratic programming (Billionnet-Elloumi-Plateau ’09)
Compute dense subgraphs for unrestricted graphs with n 6 100
Rem: SDP bounds are very tight - but expensive (Roupin ’04)
Question: use this to be competitive with best methods ?
Objective of our work:1 to study new SDP bounds - that trade tightness for cpu time,
while keeping SDP-like quality !
2 to use them within branch-and-bound for computing densestk-subgraphs
3 to compare with the best: Billionnet-Elloumi-Plateau ’09
5
Finding a densest k-subgraph ?
Difficult problem (NP-hard and more - see e.g. Khot ’05)
Solving to optimality ? Few methods:
– using linear programming (Ekrut ’90)– using reformulation techniques (Pisinger ’06)– using quadratic programming (Billionnet-Elloumi-Plateau ’09)
Compute dense subgraphs for unrestricted graphs with n 6 100
Rem: SDP bounds are very tight - but expensive (Roupin ’04)
Question: use this to be competitive with best methods ?
Objective of our work:1 to study new SDP bounds - that trade tightness for cpu time,
while keeping SDP-like quality !
2 to use them within branch-and-bound for computing densestk-subgraphs
3 to compare with the best: Billionnet-Elloumi-Plateau ’09
6
Outline
1 Formulation and new semidefinite bounds
2 Relaxed resolution: comparison of the bounds
3 Exact resolution: branch-and-bound procedure
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Formulation and new semidefinite bounds
Outline
1 Formulation and new semidefinite bounds
2 Relaxed resolution: comparison of the bounds
3 Exact resolution: branch-and-bound procedure
8
Formulation and new semidefinite bounds
Formulation of densest k-subgraph problem
Notation: G = (V,E) unweighted graph (|V | = n)W = (wij) adjancency-matrix (/2)
Initial modelling as {0, 1}-QP with constraintsmax
∑(ij)∈E wij yi yj = y>W y∑
i yi = ky ∈ {0, 1}n
Enforcement of constraints: adding n product constraints⇐⇒ adding (
∑ni=1 yi − k)2 = 0
max y>W y∑i yi = k∑ni=1 yi yj = k yj , j = 1, . . . , n
y ∈ {0, 1}n
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Formulation and new semidefinite bounds
Formulation of densest k-subgraph problem
Notation: G = (V,E) unweighted graph (|V | = n)W = (wij) adjancency-matrix (/2)
Initial modelling as {0, 1}-QP with constraintsmax
∑(ij)∈E wij yi yj = y>W y∑
i yi = ky ∈ {0, 1}n
Enforcement of constraints: adding n product constraints⇐⇒ adding (
∑ni=1 yi − k)2 = 0
max y>W y∑i yi = k∑ni=1 yi yj = k yj , j = 1, . . . , n
y ∈ {0, 1}n
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Formulation and new semidefinite bounds
Standard reformulation and lifting
Change of variables (and homogenization):Equivalent formulation as a pure {−1, 1}-QP
max x>Qxx>Qj x = 4k − 2n, j ∈ {0, . . . , n}x ∈ {−1, 1}n+1
SDP lifting (e.g. Lovasz ’79, Goemans-Williamson ’95)
〈X, Y 〉 = trace(XY ) makes x>A x = 〈A, xx>〉X = xx> gives xi ∈ {−1, 1} as Xii = 1
Equivalent formulation as linear SDP with rank-one constraintmax 〈Q,X〉〈Qj , X〉 = 4k − 2n, j ∈ {0, . . . , n}Xii = 1, i ∈ {0, . . . , n}rank X = 1, X < 0
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Formulation and new semidefinite bounds
Standard reformulation and lifting
Change of variables (and homogenization):Equivalent formulation as a pure {−1, 1}-QP
max x>Qxx>Qj x = 4k − 2n, j ∈ {0, . . . , n}x ∈ {−1, 1}n+1
SDP lifting (e.g. Lovasz ’79, Goemans-Williamson ’95)
〈X, Y 〉 = trace(XY ) makes x>A x = 〈A, xx>〉X = xx> gives xi ∈ {−1, 1} as Xii = 1
Equivalent formulation as linear SDP with rank-one constraintmax 〈Q,X〉〈Qj , X〉 = 4k − 2n, j ∈ {0, . . . , n}Xii = 1, i ∈ {0, . . . , n}rank X = 1, X < 0
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Formulation and new semidefinite bounds
Idea of the “spherical constraint”
Key remark (Malick ’07):
For all X < 0 satisfying Xii = 1,we have
‖X‖ 6 n + 1
Xii = 1X < 0
n + 1
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Formulation and new semidefinite bounds
Idea of the “spherical constraint”
Key remark (Malick ’07):
For all X < 0 satisfying Xii = 1,we have
‖X‖ 6 n + 1
‖X‖ = n + 1 ⇐⇒ rank X = 1
“spherical constraint”
n + 1
X < 0Xii = 1
X of rank 1
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Formulation and new semidefinite bounds
New formulation with the spherical constraint
Replace rank X = 1 by ‖X‖2 = (n + 1)2
New formulation of the k-densest subgraph problem as alinear SDP with one (nonconvex) quadratic constraint
max 〈Q,X〉〈Qj , X〉 = 4k − 2n, j ∈ {0, . . . , n}〈Ei, X〉 = 1, i ∈ {0, . . . , n}X < 0‖X‖2 = (n + 1)2
The difficulty is now concentrated in this spherical constraint...
Drop it: you get the usual SDP relaxation
Don’t want to do it: the SDP bound is tight, but expensive !
Idea: keep the constraint and dualize it !
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Formulation and new semidefinite bounds
Getting bounds by duality
Dualize the spherical constraint with α ∈ R
θ(α) :=
max 〈Q,X〉 − α(‖X‖2 − (n + 1)2)〈Qj , X〉 = 4k − 2n, j ∈ {0, . . . , n}〈Ei, X〉 = 1, i ∈ {0, . . . , n}X < 0
Weak duality: each θ(α) gives an upper bound
Comparison: θ(α) 6 θ(β) when α 6 β
No gap (!): in theory, bounds as tight as we want !?
θ(α) −→ val(dense subgraph) when α→ −∞
In practice: only θ(α) for α > 0 are tractable...
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Formulation and new semidefinite bounds
Getting bounds by duality
Dualize the spherical constraint with α ∈ R
θ(α) :=
max 〈Q,X〉 − α(‖X‖2 − (n + 1)2)〈Qj , X〉 = 4k − 2n, j ∈ {0, . . . , n}〈Ei, X〉 = 1, i ∈ {0, . . . , n}X < 0
Weak duality: each θ(α) gives an upper bound
Comparison: θ(α) 6 θ(β) when α 6 β
No gap (!): in theory, bounds as tight as we want !?
θ(α) −→ val(dense subgraph) when α→ −∞
In practice: only θ(α) for α > 0 are tractable...
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Formulation and new semidefinite bounds
Getting bounds by duality
Dualize the spherical constraint with α ∈ R
θ(α) :=
max 〈Q,X〉 − α(‖X‖2 − (n + 1)2)〈Qj , X〉 = 4k − 2n, j ∈ {0, . . . , n}〈Ei, X〉 = 1, i ∈ {0, . . . , n}X < 0
Weak duality: each θ(α) gives an upper bound
Comparison: θ(α) 6 θ(β) when α 6 β
No gap (!): in theory, bounds as tight as we want !?
θ(α) −→ val(dense subgraph) when α→ −∞
In practice: only θ(α) for α > 0 are tractable...
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Formulation and new semidefinite bounds
Getting bounds by duality
Dualize the spherical constraint with α ∈ R
θ(α) :=
max 〈Q,X〉 − α(‖X‖2 − (n + 1)2)〈Qj , X〉 = 4k − 2n, j ∈ {0, . . . , n}〈Ei, X〉 = 1, i ∈ {0, . . . , n}X < 0
Weak duality: each θ(α) gives an upper bound
Comparison: θ(α) 6 θ(β) when α 6 β
No gap (!): in theory, bounds as tight as we want !?
θ(α) −→ val(dense subgraph) when α→ −∞
In practice: only θ(α) for α > 0 are tractable...
19
Formulation and new semidefinite bounds
Getting bounds by duality
Dualize the spherical constraint with α ∈ R
θ(α) :=
max 〈Q,X〉 − α(‖X‖2 − (n + 1)2)〈Qj , X〉 = 4k − 2n, j ∈ {0, . . . , n}〈Ei, X〉 = 1, i ∈ {0, . . . , n}X < 0
Weak duality: each θ(α) gives an upper bound
Comparison: θ(α) 6 θ(β) when α 6 β
No gap (!): in theory, bounds as tight as we want !?
θ(α) −→ val(dense subgraph) when α→ −∞
In practice: only θ(α) for α > 0 are tractable...
20
Formulation and new semidefinite bounds
New family of SDP bounds
In fact, the useful new family of SDP bounds θ(α) with α > 0
Properties:
θ(0) is the standard SDP bound...
...computed by any SDP solver (IP, SB, PenSDP,...)
θ(α) for α > 0 boils down to a SDP least-squares problem...
...computed by nonlinear optimization methods (Malick ’04)
Key practical observation: θ(α) is easier than θ(0) to get !
But: θ(0) 6 θ(α) and θ(α) harder when α→ 0 ! So what ?
Need of a numerical study of the ratio tigthness/cpu cost
21
Formulation and new semidefinite bounds
New family of SDP bounds
In fact, the useful new family of SDP bounds θ(α) with α > 0
Properties:
θ(0) is the standard SDP bound...
...computed by any SDP solver (IP, SB, PenSDP,...)
θ(α) for α > 0 boils down to a SDP least-squares problem...
...computed by nonlinear optimization methods (Malick ’04)
Key practical observation: θ(α) is easier than θ(0) to get !
But: θ(0) 6 θ(α) and θ(α) harder when α→ 0 ! So what ?
Need of a numerical study of the ratio tigthness/cpu cost
22
Relaxed resolution: comparison of the bounds
Outline
1 Formulation and new semidefinite bounds
2 Relaxed resolution: comparison of the bounds
3 Exact resolution: branch-and-bound procedure
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Relaxed resolution: comparison of the bounds
Technical point 1: how to choose ααα ?
Our strategy = having SDP-like bounds
We fix α = 10−4 – θ(10−4) ≈ θ(0)– cpu time is reasonable
Example on an instance (with n = 300, d = 25%, k = 75)Observe when α→ 0 : convergence to θ(0) + cpu increase
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SDP Bound
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SDP Bound
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SDP Bound
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SDP Bound
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Relaxed resolution: comparison of the bounds
Technical point 1: how to choose ααα ?
Our strategy = having SDP-like bounds
We fix α = 10−4 – θ(10−4) ≈ θ(0)– cpu time is reasonable
Example on an instance (with n = 300, d = 25%, k = 75)Observe when α→ 0 : convergence to θ(0) + cpu increase
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CP
U T
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Value of α
SDP Bound
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SDP Bound
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SDP Bound
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SDP Bound
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Relaxed resolution: comparison of the bounds
Numerical comparison of standard and new SDP bounds
We compare: θ(α = 10−4) vs. the standard SDP bound θ(0)
Solvers:
– our home-made solver for θ(α) (Malick-Roupin ’10)– SB, bundle method for λmax for θ(0) (Helmberg-Rendl ’00)– CSDP, interior-point method for θ(0) (Borcher ’99)
Test-problems: graphs of Billionnet-Elloumi-Plateau ’09
Collection with 5 instances of graphs for each parameters:
– number of vertices n ∈ {80, 100, 300}– density d ∈ {25%, 50%, 75%}– size of the subgraph k ∈ {n/4, n/2, 3n/4}
For given n : 45 instances (5 for each param. setting)
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Relaxed resolution: comparison of the bounds
Numerical comparison of standard and new SDP bounds
We compare: θ(α = 10−4) vs. the standard SDP bound θ(0)
Solvers:
– our home-made solver for θ(α) (Malick-Roupin ’10)– SB, bundle method for λmax for θ(0) (Helmberg-Rendl ’00)– CSDP, interior-point method for θ(0) (Borcher ’99)
Test-problems: graphs of Billionnet-Elloumi-Plateau ’09
Collection with 5 instances of graphs for each parameters:
– number of vertices n ∈ {80, 100, 300}– density d ∈ {25%, 50%, 75%}– size of the subgraph k ∈ {n/4, n/2, 3n/4}
For given n : 45 instances (5 for each param. setting)
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Relaxed resolution: comparison of the bounds
Comparison of the solvers (1)
a result = the mean over 45 instances of same size n
θ(α), α=10−4
n time gap(%)
80 0.15” 0.07%
100 0.19” 0.08%
300 2.81” 0.05%
θ(0) by SB θ(0) by CSDP
time θ(α) time θ(α)1.09” 0.76” 0.34” 0.28”
2.9” 1.63” 0.58” 0.47”
39.64” 25.15” 10.12” 8.05”
Our solver to compute θ(α) is
quick - especially for large problems
tight - mean gap with standard SDP 6 1%reliable - running times are almost constant for given size
Ex: for n = 100, mean standard deviation of cpu times
σθ(α) = 0.02 σSB = 2.32 σCSDP = 0.11
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Relaxed resolution: comparison of the bounds
Comparison of the solvers (1)
a result = the mean over 45 instances of same size n
θ(α), α=10−4
n time gap(%)
80 0.15” 0.07%
100 0.19” 0.08%
300 2.81” 0.05%
θ(0) by SB θ(0) by CSDP
time θ(α) time θ(α)1.09” 0.76” 0.34” 0.28”
2.9” 1.63” 0.58” 0.47”
39.64” 25.15” 10.12” 8.05”
Our solver to compute θ(α) is
quick - especially for large problems
tight - mean gap with standard SDP 6 1%reliable - running times are almost constant for given size
Ex: for n = 100, mean standard deviation of cpu times
σθ(α) = 0.02 σSB = 2.32 σCSDP = 0.11
29
Relaxed resolution: comparison of the bounds
Comparison of the solvers (1)
a result = the mean over 45 instances of same size n
θ(α), α=10−4
n time gap(%)
80 0.15” 0.07%
100 0.19” 0.08%
300 2.81” 0.05%
θ(0) by SB θ(0) by CSDP
time θ(α) time θ(α)1.09” 0.76” 0.34” 0.28”
2.9” 1.63” 0.58” 0.47”
39.64” 25.15” 10.12” 8.05”
Our solver to compute θ(α) is
quick - especially for large problems
tight - mean gap with standard SDP 6 1%
reliable - running times are almost constant for given size
Ex: for n = 100, mean standard deviation of cpu times
σθ(α) = 0.02 σSB = 2.32 σCSDP = 0.11
30
Relaxed resolution: comparison of the bounds
Comparison of the solvers (1)
a result = the mean over 45 instances of same size n
θ(α), α=10−4
n time gap(%)
80 0.15” 0.07%
100 0.19” 0.08%
300 2.81” 0.05%
θ(0) by SB θ(0) by CSDP
time θ(α) time θ(α)1.09” 0.76” 0.34” 0.28”
2.9” 1.63” 0.58” 0.47”
39.64” 25.15” 10.12” 8.05”
Our solver to compute θ(α) is
quick - especially for large problems
tight - mean gap with standard SDP 6 1%reliable - running times are almost constant for given size
Ex: for n = 100, mean standard deviation of cpu times
σθ(α) = 0.02 σSB = 2.32 σCSDP = 0.11
31
Relaxed resolution: comparison of the bounds
Comparison of the solvers (2)
Example: for a graph with n = 80, d = 50%, k = 40
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Relaxed resolution: comparison of the bounds
Technical point 2: back to formulations
Performance of solvers depends on the formulations
2 equivalent {0, 1}-QP for densest subgraph problem...max y>W y
e>y = k(∑
yi − k)2 = 0y ∈ {0, 1}n
max y>W y
e>y = ky>Cj y = k yj , j = 1:ny ∈ {0, 1}n
...lead to 2 equivalentSDP relaxations...
...for which the solversbehave differently !
Choose the best for eachsolver: CSDP vs θ, SB
SDLS θs(10-4) SDLS θp(10-4) SB θs(0) SB θp(0) CSDP θs(0) CSDP θp(0)0
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Graph Size = 100
CPU
Tim
e
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Relaxed resolution: comparison of the bounds
Technical point 2: back to formulations
Performance of solvers depends on the formulations
2 equivalent {0, 1}-QP for densest subgraph problem...max y>W y
e>y = k(∑
yi − k)2 = 0y ∈ {0, 1}n
max y>W y
e>y = ky>Cj y = k yj , j = 1:ny ∈ {0, 1}n
...lead to 2 equivalentSDP relaxations...
...for which the solversbehave differently !
Choose the best for eachsolver: CSDP vs θ, SB
SDLS θs(10-4) SDLS θp(10-4) SB θs(0) SB θp(0) CSDP θs(0) CSDP θp(0)0
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Graph Size = 100
CPU
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Relaxed resolution: comparison of the bounds
Technical point 2: back to formulations
Performance of solvers depends on the formulations
2 equivalent {0, 1}-QP for densest subgraph problem...max y>W y
e>y = k(∑
yi − k)2 = 0y ∈ {0, 1}n
max y>W y
e>y = ky>Cj y = k yj , j = 1:ny ∈ {0, 1}n
...lead to 2 equivalentSDP relaxations...
...for which the solversbehave differently !
Choose the best for eachsolver: CSDP vs θ, SB
SDLS θs(10-4) SDLS θp(10-4) SB θs(0) SB θp(0) CSDP θs(0) CSDP θp(0)0
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Graph Size = 100
CPU
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Exact resolution: branch-and-bound procedure
Outline
1 Formulation and new semidefinite bounds
2 Relaxed resolution: comparison of the bounds
3 Exact resolution: branch-and-bound procedure
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Exact resolution: branch-and-bound procedure
Simple branch-and-bound
Characteristics of our branch-and-bound algorithm:
Initialization: greedy algorithm gives
– (good) feasible point– lower bound on optimal solution
Extremely simple branching strategy:
– fixed order of separation– depth-first
Bounding strategy: new SDP bound θ(α) with α = 10−4
– Our solver admits early stops– Warm-restart for sub-problems
Expect the bounding, the rest is rather standard
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Exact resolution: branch-and-bound procedure
Comparison with the best to get densest subgraphs
Comparison with QCR of Billionnet-Elloumi-Plateau ’09
Quadratic programming approach that mixes nicely– SDP for computing parameters of convex relaxation– CPLEX for branch-and-bound (MIQP to be solved)
Numerical comparison: same instances - same machine
Aggregated results
40 80 100
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Graph size
Ave
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U ti
me
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Exact resolution: branch-and-bound procedure
Comparison with the best to get densest subgraphs
Comparison with QCR of Billionnet-Elloumi-Plateau ’09
Quadratic programming approach that mixes nicely– SDP for computing parameters of convex relaxation– CPLEX for branch-and-bound (MIQP to be solved)
Numerical comparison: same instances - same machine
Aggregated results
40 80 100
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Graph size
Ave
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Exact resolution: branch-and-bound procedure
Numerical comparison: some more details
80 n
/4 2
5%
80 n
/4 5
0%
80 n
/4 7
5%
80 n
/2 2
5%
80 n
/2 5
0%
80 n
/2 7
5%
80 3
n/4
25%
80 3
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25%
80 3
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75%
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75%
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50%
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3n/4
25%
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75%
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SDLSQCR
Comparable results - with different strategies !
Our bound is more expensive but we prune very well
Ex: nb of nodes in tree for n = 100: 48,675 vs 950,04140
Exact resolution: branch-and-bound procedure
Conclusion on numerical experiments
The bounds θ(α) are interesting– they provide SDP-quality bounds– they are cheaper to get: good ratio tightness/computing-time
The solver for θ(α) combines advantages of SB and CSDP– gives guaranteed upper bounds (like SB)– has a sharp initial decrease (like SB)– is reliable (like CSDP)– we can interrupt it (like SB)
The branch-and-bound using θ(α)– uses SDP-like bounds (all way long) so prunes very well– has performances comparable with the best (that uses CPLEX)
J. Malick and F. RoupinNumerical study of SDP bounds for the k-cluster problemElectronic Notes in Discrete Mathematics: Proceedings of ISCO, 2010
J. Malick and F. RoupinSolving k-cluster problems to optimality with semidefinite programmingTo appear in Mathematical Programming, 2011
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Exact resolution: branch-and-bound procedure
Conclusion...
Essential points of this work– new formulation of rank-one constraint
– new SDP-like bounds for the densest k-subgraph
– competitive branch-and-bound to compute dense subgraphs
On-going research on these new bounds– generalisation 1: universality using α (Malick Roupin ’11)
– generalization 2: to other combinatorial problemseasy, in theory... but still requires work, in practice...
– densest k-subgraph: simple formulation but challenging forpure-SDP approach (no SDP approach)
Advertisement: next talk of Nathan Krislock on max-cut– different presentation of the family + details on computation
– max-cut admits SDP-based B&B (Wiegele et al ’09)
– managment of inequalities + control on α...
thanks !
42
Exact resolution: branch-and-bound procedure
Conclusion...
Essential points of this work– new formulation of rank-one constraint
– new SDP-like bounds for the densest k-subgraph
– competitive branch-and-bound to compute dense subgraphs
On-going research on these new bounds– generalisation 1: universality using α (Malick Roupin ’11)
– generalization 2: to other combinatorial problemseasy, in theory... but still requires work, in practice...
– densest k-subgraph: simple formulation but challenging forpure-SDP approach (no SDP approach)
Advertisement: next talk of Nathan Krislock on max-cut– different presentation of the family + details on computation
– max-cut admits SDP-based B&B (Wiegele et al ’09)
– managment of inequalities + control on α...
thanks !
43
Exact resolution: branch-and-bound procedure
Conclusion... and next talk !
Essential points of this work– new formulation of rank-one constraint
– new SDP-like bounds for the densest k-subgraph
– competitive branch-and-bound to compute dense subgraphs
On-going research on these new bounds– generalisation 1: universality using α (Malick Roupin ’11)
– generalization 2: to other combinatorial problemseasy, in theory... but still requires work, in practice...
– densest k-subgraph: simple formulation but challenging forpure-SDP approach (no SDP approach)
Advertisement: next talk of Nathan Krislock on max-cut– different presentation of the family + details on computation
– max-cut admits SDP-based B&B (Wiegele et al ’09)
– managment of inequalities + control on α...
thanks !
44
Exact resolution: branch-and-bound procedure
Conclusion... and next talk !
Essential points of this work– new formulation of rank-one constraint
– new SDP-like bounds for the densest k-subgraph
– competitive branch-and-bound to compute dense subgraphs
On-going research on these new bounds– generalisation 1: universality using α (Malick Roupin ’11)
– generalization 2: to other combinatorial problemseasy, in theory... but still requires work, in practice...
– densest k-subgraph: simple formulation but challenging forpure-SDP approach (no SDP approach)
Advertisement: next talk of Nathan Krislock on max-cut– different presentation of the family + details on computation
– max-cut admits SDP-based B&B (Wiegele et al ’09)
– managment of inequalities + control on α...
thanks !
45