Growing strings in a chemical reaction space for searching retrosynthesis pathways
- Carlo Baldassari
- Jannis Born
- et al.
- 2023
- ACS Spring 2023
Talk
Publications
3556 results for Materials Discovery
NeuTE - Neural Template Extraction
- Amol Thakkar
- Teodoro Laino
- 2023
- ACS Spring 2023
TalkEnzyme optimization via a generative language modeling-based evolutionary algorithm
- Yves Gaetan Nana Teukam
- Francesca Grisoni
- et al.
- 2023
- ACS Spring 2023
TalkComputational screening of solid sorbent materials for CO2 capture from molecular to process level
- Rodrigo Neumann Barros Ferreira
- Binquan Luan
- et al.
- 2023
- ACS Spring 2023
PosterDevelopment of Ensemble Models for the Growth of Colloidal Spin-on-Glass Materials
- 2023
- APS March Meeting 2023
TalkMolecular rotations trigger a glass-to-plastic fcc heterogeneous crystallization in high-pressure water
- Malgorzata Zimon
- Fausto Martelli
- 2023
- The Journal of Chemical Physics
PaperImproved Knowledge Representation Enables AI-Guided Polymer Design and Experimental Validation
- 2023
- APS March Meeting 2023
TalkPhase transitions beyond criticality: normal form and analytic corrections for the 2D Ising Model
- David Hathcock
- James P. Sethna
- 2023
- APS March Meeting 2023
TalkSteady-like topology of the hydrogen bond network in supercooled water
- Fausto Martelli
- 2023
- APS March Meeting 2023
TalkEpitaxial, Silicon-Compatible CoSi2 Thin Film SQUID with Constriction-Type Junction
- Ruoshui Li
- Yichen Jia
- et al.
- 2023
- APS March Meeting 2023
Talk