Molecular Design

Controlling the behavior of compounds and materials by manipulation of molecular properties.

Tuesday, 4 August 2026

OpenADMET: Response to Pat Walters

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Pat Walters responded to my post on the OpenADMET initiative and I am responding to his post. As is normal for posts here my responses ar...
Monday, 27 July 2026

The OpenADMET initiative

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“Quantity has a quality all of its own” Original source unknown The quote with which I’ve opened the post on the OpenADMET initiative is of...
Monday, 22 June 2026

The OpenBind initiative

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I’ll open the post on the OpenBind initiative with photos from my visit last year to Korea which was timed to coincide with the cherry blos...
Wednesday, 3 June 2026

Two new open data initiatives

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I'll open the post with photos that I took in Seoul last year at the Dongdaemun Design Plaza ( DDP ) which was designed by Zaha Hadid  (...
Wednesday, 27 May 2026

Grand Challenges for Predictive Modeling in Small Molecule Drug Discovery

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In this blog post I’ll be taking a look at  C2026 (Grand Challenges for Predictive Modeling in Small Molecule Drug Discovery) which has bee...
Wednesday, 20 May 2026

The objectives of drug design

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I'll open the post on drug design objectives with photos from a most enjoyable and informative visit to the Australian Synchrotron early...
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