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Ant's Rant - The First of Many

There’s been a lot of hot air blowing around lately about Bill Gates’s decision to invest $10M in our friends at Schrodinger. Some have even suggested that this might mean a return to the heady days of...

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The Rant Goes On…

In August, I gave a talk at the Boston ACS meeting about the contribution of academics to molecular modeling. Okay, their lack of contribution to molecular modeling. I might even have had a slide that...

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Cloud Computing

I am frequently being asked by our users whether OpenEye's licensing model allows them to run OpenEye software in the cloud. As this appears to be a common concern and a potential legal stumbling block...

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The Bayh-Dole Act

In my last post, I ranted on about the problems surrounding contributions by academics to molecular modeling, and cited as a particular issue the Bayh-Dole Act (BD), which enabled and encouraged...

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Recommendation System for Compound Selection

Just recently, Swann et al. of Abbott Labs published "A Unified, Probabilistic Framework for Structure- and Ligand-Based Virtual Screening" in the Journal of Medicinal Chemistry. If you haven’t read it...

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What Is Really Killing Pharma

Sometimes it’s frustrating being in the business of servicing an industry so manifestly important and so manifestly stupid. I started OpenEye to help those I had come to know in pharma do a better job,...

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Curing Pharma: (1) Avoiding Hype-based Science

I’ve been thinking a lot lately about Jacques Tati’s masterful 1967 work Play Time, which describes an antiseptic, colorless and angular world of the future, a bleak world that only relents when the...

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On the Passing of Andrew Grant

Of the many reasons to restart my blog I expected least the death of a friend. As many of you know, Andrew Grant of AstraZeneca and long-time OpenEye collaborator, passed away on the 29th of December....

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A Different Conference

http://www.grc.org/programs.aspx?year=2013&program=caddread more

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CD and MD

When the recent Nobel Prize for Chemistry was announced, going to Karplus, Levitt and Warshel I assumed it must have been for “Services to Molecular Dynamics”. As such, I joined the debate on Derek...

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