Dr. St❦fan Gugler

Postdoc @TUBerlin/@bifoldberlin. PhD in ML for quantum chem @ETH. Phil of Sci/Chem and politics. 日本語でおｋ

[Dr. St❦fan Gugler @stevain]

Normalize academics talking about their failures. I'll go first: We got rejected at Berghain on Saturday night.

[Dr. St❦fan Gugler @stevain]

@eigengenesis you learned on n_shells (principal quantum number), block (orbital angular mom), and valence number (electron config). how can you claim you told it nothing about electrons, orbitals and QM when you told it basically everything ?

[Dr. St❦fan Gugler @stevain]

@pmddomingos There is some prelim evidence that force fields may achieve sota performance without explicitly encoding equivariance or energy conservation. But yeah, exploiting sym is still a great bet.

https://t.co/xGrSgMMGmc
https://t.co/4LRICqIbOG

[Dr. St❦fan Gugler @stevain]

I'll be at Pacifichem this week, hit me up if you wanna have a coffee! ☕

[Dr. St❦fan Gugler @stevain]

I'm in San Diego this week for NeurIPS, hit me up if you wanna have a coffee ☕

[Dr. St❦fan Gugler @stevain]

I'm in San Diego this week for NeurIPS, hit me up if you wanna have a coffee ☕

[Dr. St❦fan Gugler @stevain]

@MarkNeumannnn Me too!

[Dr. St❦fan Gugler @stevain]

I'm in Oslo this week for WATOC, hit me up if you wanna have a coffee ☕

[Dr. St❦fan Gugler @stevain]

@no_earthquake The true story of _italics_ c o v i d 1 9

[Dr. St❦fan Gugler @stevain]

@marceldotsci stop him for his own good 🥲

[Dr. St❦fan Gugler @stevain]

@MarioKrenn6240 @uni_tue Super cool, congratulations Mario :)

[Dr. St❦fan Gugler @stevain]

Post on previous work: https://t.co/oSMB7w8sQN and https://t.co/gvrZht5iQK

[Dr. St❦fan Gugler @stevain]

First publication of my postdoc in Berlin is out on arXiv today! 🎉

~~> We use diffusion probabilistic models to relax distorted molecules. No out-of-equilibrium data needed!

A little 6-thread🧵

[Dr. St❦fan Gugler @stevain]

We have a new paper on diffusion!📄

Faster diffusion models with total variance/signal-to-noise ratio disentanglement! ⚡️

Our new work shows how to generate stable molecules in sometimes as little 8 steps and match EDM’s image quality with a uniform time grid. 🧵

[Dr. St❦fan Gugler @stevain]

9/ Check it yourself:

🔗: https://t.co/ccUMB9p2HZ
📄: https://t.co/zBhpYBtROQ

Thanks to Khaled, Winnie, Oliver, Klaus, and Shin for the cool collaboration as well as @bifoldberlin @ml_tuberlin @TUBerlin @RIKEN_AIP_EN @RIKEN_AIP