Archive for April 22nd, 2020

A databank of molecular dynamics reaction trajectories (DDT) focused on undergraduate teaching.

Wednesday, April 22nd, 2020

In a previous post, I talked about a library of reaction pathway intrinsic reaction coordinates (IRCs) containing 115 examples of organic and organometallic reactions. Now (thanks Dean!) I have been alerted to a brand new databank of dynamics trajectories (DDT), with the focus on those reactions taught in undergraduate organic chemistry courses, some of which are shown below.

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