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Space and the Linear Free Energy Formalism

Chemical Space and the Linear Free Energy Formalism [Pg.128]

QSAR analyses are based on the linear free energy relationships (LFER) formalism, where AGbj j, the standard free energy of binding, is directly pro- [Pg.128]

Numerically, AGbi d at 37 °C is approximately 6.0pKd (kj/mol), or 1.42pKj3 (kcal/mol). By comparing the binding free energy at various affinities, it can be observed that, even at extremely low M), AGbi d remains [Pg.130]




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Energy space

Formalism Free energy

Linear formalism

Linear space

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