Final published version
Research output: Contribution to Journal/Magazine › Journal article › peer-review
Research output: Contribution to Journal/Magazine › Journal article › peer-review
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TY - JOUR
T1 - Some experiences with solving semidefinite programming relaxations of binary quadratic optimization models in computational biology
AU - Engau, Alexander
PY - 2014/3/27
Y1 - 2014/3/27
N2 - We present two recent integer programming models in molecular biology and study practical reformulations to compute solutions to some of these problems. In extension of previously tested linearization techniques, we formulate corresponding semidefinite relaxations and discuss practical rounding strategies to find good feasible approximate solutions. Our computational results highlight the possible advantages and remaining challenges of this approach especially on large-scale problems.
AB - We present two recent integer programming models in molecular biology and study practical reformulations to compute solutions to some of these problems. In extension of previously tested linearization techniques, we formulate corresponding semidefinite relaxations and discuss practical rounding strategies to find good feasible approximate solutions. Our computational results highlight the possible advantages and remaining challenges of this approach especially on large-scale problems.
KW - Combinatorial optimization
KW - integer programming
KW - binary quadratic programming
KW - semidefinite programming
KW - doubly non-negative relaxation
KW - computational biology
KW - protein folding
KW - protein similarity
KW - rotamer assignment
KW - contact map overlap
U2 - 10.1142/S0217595914500225
DO - 10.1142/S0217595914500225
M3 - Journal article
VL - 31
JO - Asia-Pacific Journal of Operational Research
JF - Asia-Pacific Journal of Operational Research
SN - 0217-5959
IS - 4
M1 - 1450022
ER -