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Genetic algorithm variants in Predicting Protein Structure

机译:预测蛋白质结构的遗传算法变体

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Proteins are the machinery of life and common to all organisms. In Protein Structure Prediction (PSP) the tertiary structure of a protein is predicted by using its primary structure information. It can help in the design of new drugs and medicines. As PSP problem has been proved to be an NP-hard problem we go for meta-heuristic techniques to solve it. In this paper, we have taken six variants of Genetic Algorithms (GA), applied them in predicting protein structure and compared their performances. As GA has several genetic operators, such as, selection, crossover and mutation, we can modify them to improve the overall performance. On the basis of selection we have considered three variants: GA1 uses rank selection method, GA2 uses elitist selection method and GA3 uses tournament selection method. All these variants are implemented taking two types of crossovers, such as, single point crossover and double point crossover. In this way, six variants have been implemented. It is observed that GA2 with two point crossover outperforms other variants in minimizing energy.
机译:蛋白质是生命的机械和所有生物共同。在蛋白质结构预测(PSP)中,通过使用其主要结构信息预测蛋白质的三级结构。它可以帮助设计新药和药物。由于PSP问题被证明是一个NP难题,我们参加了荟萃启发式技术来解决它。在本文中,我们已经拍摄了六种遗传算法(GA)变体,施加在预测蛋白质结构中并比较其性能。由于GA有几个遗传算子,例如选择,交叉和突变,我们可以修改它们以提高整体性能。在选择的基础上,我们已经考虑了三个变体:Ga1使用等级选择方法,Ga2使用Elitist选择方法和Ga3使用锦标赛选择方法。所有这些变型都是通过两种类型的交叉实现,例如单点交叉和双点交叉。以这种方式,已经实施了六种变体。观察到具有两个点交叉的Ga2优于最小化能量的其他变体。

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