Prein, Thorben
7 publications
ICML
2025
Regress, Don’t Guess: A Regression-like Loss on Number Tokens for Language Models
Jonas Zausinger, Lars Pennig, Anamarija Kozina, Sean Sdahl, Julian Sikora, Adrian Dendorfer, Timofey Kuznetsov, Mohamad Hagog, Nina Wiedemann, Kacper Chlodny, Vincent Limbach, Anna Ketteler, Thorben Prein, Vishwa Mohan Singh, Michael Danziger, Jannis Born ICLRW
2025
Retro-Rank-in: A Ranking-Based Approach for Inorganic Materials Synthesis Planning
Thorben Prein, Elton Pan, Sami Haddouti, Marco Lorenz, Janik Jehkul, Tymoteusz Wilk, Cansu Moran, Menelaos Panagiotis Fotiadis, Artur P. Toshev, Elsa Olivetti, Jennifer L.M. Rupp NeurIPSW
2024
A Chemically-Guided Generative Diffusion Model for Materials Synthesis Planning
Elton Pan, Soonhyoung Kwon, Sulin Liu, Mingrou Xie, Yifei Duan, Thorben Prein, Killian Sheriff, Yuriy Roman, Manuel Moliner, Rafael Gomez-Bombarelli, Elsa Olivetti NeurIPSW
2024
Reaction Graph Networks for Inorganic Synthesis Condition Prediction of Solid State Materials
Thorben Prein, Fuzhan Rahmanian, Kesava Prasad Arul, Jasmin El-Wafi, Menelaos Panagiotis Fotiadis, Jan Heimann, Paul Weinmann, Yifei Duan, Elton Pan, Elsa Olivetti, Jennifer L.M. Rupp