An Algorithm for Optimal Bipartite PLA Folding

This paper presents some results of PLA area optimizing by means of its column and row folding. A more restricted type of PLA simple folding is considered. It is introduced by Egan and Liu and called as bipartite folding. An efficient approach is presented which allows finding an optimal bipartite folding without exhaustive computational efforts.

Integer Programming Approach to HP Folding

One of the most widely studied protein structure prediction models is the hydrophobic-hydrophilic (HP) model, which explains the hydrophobic interaction and tries to maximize the number of contacts among hydrophobic amino-acids. In order to find a lower bound for the number of contacts, a number of heuristics have been proposed, but finding the optimal solution is still a challenge. In this research, we focus on creating a new integer programming model which is capable to provide tractable input for mixed-integer programming solvers, is general enough and allows relaxation with provable good upper bounds. Computational experiments using benchmark problems show that our formulation achieves these goals.