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Specific amino acid recognition by aspartyl-tRNA synthetase studied by free energy simulations
(1998)
Specific amino acid binding by aminoacyl-tRNA synthetases is necessary for correct translation of the genetic code. To obtain insight into the origin of the specificity, the binding to aspartyl-tRNA synthetase (AspRS) of ...
Free energy simulations: The meaning of the individual contributions from a component analysis
(1994)
A theoretical analysis is made of the decomposition into contributions from individual interactions of the free energy calculated by thermodynamic integration. It is demonstrated that such a decomposition, often referred ...