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Fig. 2 | BMC Bioinformatics

Fig. 2

From: Development of a group contribution method for estimating free energy of peptides in a dodecane-water system via molecular dynamic simulations

Fig. 2

Construction of the forty simulation boxes. The left side of the figure represents the single amino acid box construction where each amino acid was simulated in the interface dodecane-water. The right side of the figure represents the pair in the simulation box, where all the combinations were constructed using Alanine and other amino acid

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