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- W1978587434 abstract "A method that locates transition state structures between homologous reactions and, with the use of the thermodynamic cycle-perturbation technique, determines the relative free energy of activation between the transition states is presented. A simple model system which displays the problem of finding condensed phase transition states is used to illustrate the method." @default.
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- W1978587434 date "1987-10-01" @default.
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- W1978587434 title "Geometric considerations in the calculation of relative free energies of activation" @default.
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- W1978587434 doi "https://doi.org/10.1016/0009-2614(87)80096-9" @default.
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