Integrating Chemical Language and Physicochemical Features for Enhanced Molecular Property Prediction with Multimodal Language Models
- 2023
- KDD 2023
Kristin Schmidt
Pronouns
She/Her/Hers
Title
Strategy Assistant for Accelerated Discovery & Vice-Chair of Physical Sciences Council
Bio
Kristin received her PhD in polymer physics from the University of Bayreuth, Germany and continued her career at the University of California, Santa Barbara, BASF and SLAC National Laboratory before joining IBM in 2014. Currently, Kristin is managing the accelerated materials discovery group at IBM Research in Almaden. Her team develops AI solutions to help scientific experts discover and invent faster. She is also the vice-chair of the physical science council and in this role, she supports high risk, high reward exploratory research at IBM research.
Publications
Toward Human-AI Co-creation to Accelerate Material Discovery
- Dmitry Zubarev
- Carlos Raoni De Alencar Mendes
- et al.
- 2022
- NeurIPS 2022
A system for understanding molecular formula patterns for non-stoichiometric, variable inorganic compounds
- Tom Griffin
- Kristin Schmidt
- 2022
- ACS Fall 2022
PGT: a prompt based generative transformer for the patent domain
- Dimitrios Christofidellis
- Antonio Berrios Torres
- et al.
- 2022
- ICML 2022
Identification of structural phases in ferroelectric hafnium zirconium oxide by density-functional-theory-assisted EXAFS analysis
- Mehmet Alper Sahiner
- Rory J. Vander Valk
- et al.
- 2021
- Applied Physics Letters
Ultrathin extreme ultraviolet patterning stack using polymer brush as an adhesion promotion layer
- Indira Seshadri
- Anuja De Silva
- et al.
- 2017
- J. Micro/Nanolithogr. MEMS MOEMS
DSA patterning options for logics and memory applications
- Chi Chun Liu
- Elliott Franke
- et al.
- 2017
- SPIE Advanced Lithography 2017
Electrical study of DSA shrink process and CD rectification effect at sub-60nm using EUV test vehicle
- Cheng Chi
- Chi Chun Liu
- et al.
- 2017
- SPIE Advanced Lithography 2017
Ultrathin EUV patterning stack using polymer brush as an adhesion promotion layer
- Indira Seshadri
- Anuja De Silva
- et al.
- 2017
- SPIE Advanced Lithography 2017
Design technology co-optimization assessment for directed self-Assembly-based lithography: Design for directed self-Assembly or directed self-Assembly for design
- Kafai Lai
- Chi Chun Liu
- et al.
- 2017
- J. Micro/Nanolithogr. MEMS MOEMS
Patents
Projects
Sustainable Replacements for PFAS
We're addressing the environmental and human health impact of PFAS ‘forever chemicals’ by accelerating the discovery of sustainable replacements and improved capture materials.
Accelerator Technologies
We're developing technological solutions to assist subject matter experts with their scientific workflows by enabling the Human-AI co-creation process.
Blog posts
Accelerating discovery for societal and economic impact
ExplainerJed Pitera, Mathias Steiner, Daniel P. Sanders, Young-Hye Na, Maxwell Giammona, Kristin Schmidt, and Tim Erdmann
Top collaborators
NP
Nathaniel Park
Research Staff Member
EA
Emilio Vital Brazil
Senior Research Scientist - Manager AI-Assisted Decision Making
RF
Renato Cerqueira
Senior Manager, Knowledge-centric Systems
EA
Eduardo Soares
Research Scientist