From: <mar...@tu...> - 2007-05-02 15:46:51
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In Jmol I really miss displaying electrostatic potential with /Rasmol/ coloring scheme (it is usefull for depicting small variances in partial charges and handy for educational purposes) for every file type. In Chime there was a possibility to display electrostatic potential for every file type (eg. MOL), nowdays in Jmol we can display it only for certain file types. In addition, for files without appropriate data (MOL, CML), label %P displays partial charge=0 instead of -- or some approximation (as in Accelrys ViewerLite). I will enjoy to have possibility to display such rough approximation (electrostatic potential with /Rasmol/ coloring scheme) and/or label for partial charge for files without appropriate data. -------------- ****Distinguished SW, excellent work!! ------------- Martin Slavik |