Rowan Newsletter
Ari Wagen, Corin Wagen, Eli Mann, Jonathon Vandezande, Spencer SchneiderRowan is building modern computational tools for chemistry.
| Platform |  | Pricing | Only free issues |
|---|---|---|---|
| Publishes | Weekly | Issues | 27 |
| Subscribers | Read | rowansci.substack.com |
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Latest Issues
Recent posts by this newsletter. Browse the email archive.
A New RDKit-Native API
Saint Jerome In His Study, Albrecht Dürer (1521). Saint Jerome is the patron saint of translators.
Hydrogen-Bond-Basicity Prediction Made Easy
Hydrogen bonding is one of the most fundamental interactions in chemistry: hydrogen bonds hold liquid water together (see above image, which has water in it) and are important structural elements in virtually every protein–ligand complex. B...
Benchmarking NNPs, Orb-v2, and MACE-MP-0
Progress in the space of neural network potentials (NNPs) is incredibly fast—there are new advances practically every month, and keeping track of what’s possible with NNPs is practically a full-time job. At Rowan, we’re committed to keeping...
Molecular Orbitals and Isosurfaces
There are lots of ways to think about where electrons are in molecules, ranging from plum puddings (whatever those are) to Lewis structures to orbitals. Orbitals, which are computed using quantum mechanics, accurately describe the location ...
Authors
The writers behind this newsletter.
software for drugs & materials at Rowan, anti-gnostic
☧, husband/father, computational/organic chemist
Director of Computational Chemistry at RowanSci, building computational tools for all chemists, not just the experts.
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