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• W2023179701 abstract "The polarizable continuum model of Miertus et al. was implemented in the semiempirical molecular orbital method SINDO1. A fast and precise method for the calculation of solvation energies is achieved based on isodensity surfaces for the cavity surface and on approximated electrostatic potentials. The calculated solvation energies in water agree well with experimental and other calculated data. © 1997 by John Wiley & Sons, Inc." @default.
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• W2023179701 date "1997-01-15" @default.
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• W2023179701 title "Solvation effects in SINDO1: Application to organic molecules" @default.
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• W2023179701 doi "https://doi.org/10.1002/(sici)1096-987x(19970115)18:1<1::aid-jcc1>3.0.co;2-u" @default.
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