Computational Chemistry Highlights: some numbers
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Excerpt from an email I sent out to the CCH editors:
CCH has received 8401 page views to date (according to
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YouTube Physics features our infrared videos
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AAPT's Physics Teacher runs a column called YouTube Physics edited by Diane
Riendeau, an award-winning physics teacher. In May, the entire columnfeatured fi...
Aromatic stabilization energy of corannulene
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How should one assess the aromatic stabilization energy of non-planar
compounds like corannulene 1? The standard approach might be to employ the
homodesmot...
When Mol files go wrong III
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Let's play spot the difference. Are the following structures the same? (Mol
files from CHEMBL186139 and CHEMBL1180158.)
But if they're the same, then how ...
Application printed
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My application for a PostDoc scholarship (described here) is now complete.
I just hope that my research on new light sources will make up for all the
trees...
Programming the Ideal Gas
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You've heard about it before. Many times. It's a model system used a lot in
chemistry. The Ideal Gas law: A system where the particles can be treated
as no...
Open Science, Open Access and Open Source
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I have been thinking this over for quite a while, and have written this
post several times over in my mind. As an undergraduate student I remember
admiri...
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