Philipp Marquetand

📢 Paper + code release 📃💻

After 2 years of work, I'm excited to announce our newest paper, MatterGen, has been published in Nature!
www.nature.com/articles/s41...

We are also releasing all the training data, model weights, model code, and evaluation code on GitHub!
github.com/microsoft/ma...

⚠️ Readable Paper Alert ⚠️

BLT: what if we just got rid of tokenization?

Result:

* text looks a lot like audio, video, PDF, it’s all just bytes
* dynamically reduce compute based on difficulty
* new scaling axis (patch size)

ai.meta.com/research/pub...

There are already many excellent expert reviews on MLPs, so why adding more to the mix?

We want to give a light intro into the field for new starters going from the historical developments to latest developments on going beyond locality to foundation models.

dx.doi.org/10.1088/1361-648X/ad9657

Scientists, academics, researchers: We’re excited to share that @altmetric.com is now tracking mentions of your research on Bluesky! 🧪

Jobs -

Hello! I'm posting this both here and on the X-rated site, let's see where it gets more re-posts 😇. We are looking for a research software engineer to help us develop (even) better code for #compchem #atomicscale #machinelearning. Check out the specs and apply!
www.epfl.ch/labs/cosmo/i...

With less than 1M compounds, our VQM24 dataset sets a new SOTA covering more comprehensively the compositional and configurational space of small molecules. Wonderful joint efforts by current and past team-members and collaborators. Hopefully useful for
#ML
&
#compchem arxiv.org/abs/2405.05961

Timon S. Gutleb, Rhyan Barrett, Julia Westermayr, Christoph Ortner
Parameterizing Intersecting Surfaces via Invariants
https://arxiv.org/abs/2407.03731

Senior Machine Learning Researcher (GenAI) - Canva Austria (f/m/x) Join the team redefining how the world experiences design. Servus, hey, g'day, mabuhay, kia ora, 你好, hallo, vítejte! Thanks for stopping by. We know job hunting can be a little time consuming and you'...

3. Join my team at Canva if you are a senior ML researcher in the domain of Generative AI: www.lifeatcanva.com/en/jobs/6000...

SPAINN: equivariant message passing for excited-state nonadiabatic molecular dynamics Excited-state molecular dynamics simulations are crucial for understanding processes like photosynthesis, vision, and radiation damage. However, the computational complexity of quantum chemical calcul...

2. SpaiNN: Equivariant Message Passing for Excited-State Nonadiabatic Molecular Dynamics in #ChemSci improving our previous approach. Read more at
Chem. Sci. 15, 15880 (2024).

1. An example molecule, thiophene in this case, is excited with an ultra-short broadband laser pulse and the dynamics on different electronic state potentials runs at the same time coherently, leading to long-lasting signals. Read more at Phys. Rev. A 110, 033118 (2024).

Some steps from my life:
1. Quantum dynamics
2. ML in chemistry
3. ML for graphic design
Reflected in some publications and an advert from this year:
1. doi.org/10.1103/Phys...
2. doi.org/10.1039/D4SC...
3. www.lifeatcanva.com/en/jobs/6000...
More info below