COSMOtherm as a Valuable Tool for Cocrystal Screening and Development




COSMOtherm is a widely used versatile software tool for the prediction of thermodynamic properties in liquid systems. Only recently it has been shown that COSMOtherm as well can be used for accurate and efficient screening of cocrystallization coformers. The excess enthalpy Hex between an API-coformer mixture and the respective pure components as computed by COSMOtherm reflects the tendency of those two compounds to cocrystallize. Most likely due to its detailed and accurate description of all...
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