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ZetaPotential and ParticleSize descriptors #4

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ammar257ammar opened this issue Jul 25, 2020 · 0 comments
Open

ZetaPotential and ParticleSize descriptors #4

ammar257ammar opened this issue Jul 25, 2020 · 0 comments

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@ammar257ammar
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Dear Egon,

I am trying to apply NanoJava descriptor calculation on Gold oxide and Silver oxide nano particles. I made a CML XML file containing both of them (please see the attachment). When I run the calculation against this file, I get NaN for both the ZetaPotentialDescriptor and ParticleSizeDescriptor. Knowing that these values are already provided in the XML file under the corresponding ontology term.
oxides.zip

Thank you
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