Rowan Newsletter
Ari Wagen, Corin Wagen, Eli Mann, Jonathon Vandezande, Spencer Schneider, Ishaan Ganti, Zachary Fried, Raphael Stone, Nick CasettiRowan is building modern computational tools for chemistry.
| Platform |  | Pricing | Only free issues | Publishes | Weekly |
|---|---|---|---|---|---|
| Issues | 77 | Founded | 3 years ago | Last Issue | 7 days ago |
| Active | |||||
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rowansci.substack.comLatest Issues
LogP, API Key Budgets, and a User Survey
Ehud Kills Eglon, King of the Moabites, Teofoli Torri (c. 1608)
LogP
The logarithm of the octanol–water partition coefficient, logP, is a crucial quantity for small-molecule therapeutics. LogP measures a compound’s lipophilicity or “fa...
NMR Spectroscopy
The Holy Family with a Little Bird, Bartolomé Esteban Murillo (c. 1650)
We’re excited to launch Rowan’s nuclear-magnetic-resonance (NMR) workflow, which uses the new MagNET ML model to predict 1H and 13C NMR spectra. This workflow is the r...
Automating Transition-State Search
Nude Descending a Staircase, No. 2. Marcel Duchamp (1912)
We’re releasing a completely rewritten reaction toolkit today, coinciding with our presentation about it at the Gordon Research Conference on “Molecular Discovery and Simulation in...
Well-Prepared Proteins and How to Use Them
Still Life with a Rib of Beef, Jean Siméon Chardin (1739)
We’re excited to share a variety of updates to Rowan’s structure-based drug discovery toolkit today. As we work to support more and more biotech/pharma teams, we’ve been finding lot...
Symmetry, X-Ray Diffraction (XRD), Band Structures, and Elastic Tensors
Wedding Supper, Martin Van Meytens (1763)
Molecules and materials often contain atoms that are identical except for rotations, translations, or reflections. Identifying these symmetry elements is useful for understanding the properties of...
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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.
Computational Chemist at Rowan
Materials Scientist
Nick is currently a computational chemistry intern at Rowan and a PhD candidate at MIT in Connor Coley's lab
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