The electronic structure properties of 20 L-amino acids in neutral and zwitterion forms: Quantum-chemical calculations |
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Authors: | K. A. Scherbakov M. S. Kondratiev A. A. Samchenko A. V. Kabanov V. M. Komarov |
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Abstract: | The conformational diversity of the 20 DNA-encoded proteinogenic amino acids and their zwitterions in the gaseous state and in the state with the first hydration shell was analyzed using the PM3 and PM7 semi-empirical quantum-chemistry programs. |
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