Molecular big data
Using quantum mechanical calculations, a dataset of 62k organic molecules was generated
We generated a dataset of 61,489 molecules extracted from organic crystals in the Cambridge Structural Database. For each molecule, the geometry and several electronic properties calculated with density-functional theory are available. For two subsets, we also supply data from higher level methods, such as hybrid functionals and the GW Green's function method. The dataset is available at Nature Scientific Data. The data is open access and can be freely used for applications, data science and machine learning.
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DeployAI Partners Gather for Heart Beat Meeting in Helsinki
The European DeployAI project's partners gathered for the Heart Beat meeting hosted by Aalto University Executive Education in Helsinki.
Aalto computer scientists in ICML 2024
Computer scientists in ICML 2024
In low-hierarchy organisations, even key policy issues are discussed in Slack
In a recent study, Aalto University alumn Lauri Pietinalho, a visiting scholar at New York University's Stern School of Business, and Frank Martela, an assistant professor at Aalto University, investigated how low-hierarchy organisations deal with shared policies in confrontational situations and how authority functions within them.