Project Jupyter is the winner of the White House OSTP “Technical Advancement to Enable Open Science” category. Open science relies on technical advancements and infrastructures
Year: 2024
I just want to highlight the submission deadline for poster submission for the 7th Artificial Intelligence in Chemistry Symposium. The deadline is 3 May 2024,
This is a feature update (v10.0) to the ChemDoodle Web Components library. Additions
To all KNIME Analytics Platform users on macOS on Apple Silicon processors M1, M2, and M3: We were informed about a problem introduced by the
The latest Rowan newsletter highlights security. https://rowansci.substack.com/p/taking-security-seriously In particular, they have improved the internal security to protect data in submitted jobs. You can read more
Registration is open for the Molecular Simulation in Chemistry and in particular it is open for poster abstract submission. This is a great opportunity for
Registration for the 2024 RDKit UGM, being held from 11-13 September at the ETH in Zurich, Switzerland, is now open. https://www.eventbrite.com/e/13th-rdkit-ugm-2024-tickets-860637719587 The UGM will be
I have a large collection of structural databases, these range from vendor catalogues, to copies of various tranches of Zinc to copies of all proteins
A couple of months ago I published a post describing Rowan a web native quantum chemistry package. I just noticed there is an update that
I suspect many people have been anticipating this, whilst AlphaFold was a great step forward in predicting protein 3D structure it did have significant limitations.