Abstract
A force field model was designed with respect to the special needs of bile pigments. It is parametrized and tested using partial structures of bile pigments as well as an integral pigment; the solution structures of the molecules were previously deduced using independent experimental methods.
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38. Mitt::Falk, H., Schlederer, T., Wolshann, P., Mh. Chem.112, 199 (1981).
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Falk, H., Höllbacher, G., Hofer, O. et al. Beiträge zur Chemie der Pyrrolpigmente, 39. Mitt.: Ein Kraftfeldmodell zur konformationsanalytischen Untersuchung von Gallenfarbstoffen. Monatshefte für Chemie 112, 391–403 (1981). https://doi.org/10.1007/BF00900769
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DOI: https://doi.org/10.1007/BF00900769