Understanding the potency of fatty acids with the amino acid side chains of bovine β lactoglobulin-A quantum chemical approach.

@article{Palanisamy2017UnderstandingTP,
  title={Understanding the potency of fatty acids with the amino acid side chains of bovine β lactoglobulin-A quantum chemical approach.},
  author={Deepa Palanisamy and B Vijaya Pandiyan and Thirumeignanam Duraisamy and P. Kolandaivel},
  journal={Journal of molecular graphics & modelling},
  year={2017},
  volume={74},
  pages={105-116}
}
The present study aims to spotlight on the strength of interaction between different fatty acids with the Bovine-lactoglobulin (LGB) protein side chains along with the crystal water molecules at M062X/def2-QZVP level of theory. To analyse the role of carboxylic acid and its interaction with side chains and to reveal the significance of carboxylic acid, it… CONTINUE READING