Carl Edwards

27 papers A* 4A 2Journal 17Unranked 4
YearRankTypeTitle / Venue / Authors
2026 J jnl
DC-W2S: Dual-Consensus Weak-to-Strong Training for Reliable Process Reward Modeling in Biological Reasoning.
CoRR
Chi-Min Chan, Ehsan Hajiramezanali, Xiner Li, Edward De Brouwer, Carl Edwards, Wei Xue, Sirui Han, Yike Guo, Gabriele Scalia
2025 J jnl
Artificial Intelligence for Science in Quantum, Atomistic, and Continuum Systems.
Found. Trends Mach. Learn.
Xuan Zhang, Limei Wang, Jacob Helwig, Youzhi Luo, Cong Fu, Yaochen Xie, Meng Liu, Yuchao Lin, Zhao Xu, Keqiang Yan, Keir Adams, Maurice Weiler, Xiner Li, Tianfan Fu, Yucheng Wang, Alex Strasser, Haiyang Yu, Yuqing Xie, Xiang Fu, Shenglong Xu, Yi Liu, Yuanqi Du, Alexandra Saxton, Hongyi Ling, Hannah Lawrence, Hannes Stärk, Shurui Gui, Carl Edwards, Nicholas Gao, Adriana Ladera, Tailin Wu, Elyssa F. Hofgard, Aria Mansouri Tehrani, Rui Wang, Ameya Daigavane, Montgomery Bohde, Jerry Kurtin, Qian Huang, Tuong Phung, Minkai Xu, Chaitanya K. Joshi, Simon V. Mathis, Kamyar Azizzadenesheli, Ada Fang, Alán Aspuru-Guzik, Erik J. Bekkers, Michael M. Bronstein, Marinka Zitnik, Anima Anandkumar, Stefano Ermon, Pietro Liò, Rose Yu, Stephan Günnemann, Jure Leskovec, Heng Ji, Jimeng Sun, Regina Barzilay, Tommi S. Jaakkola, Connor W. Coley, Xiaoning Qian, Xiaofeng Qian, Tess E. Smidt, Shuiwang Ji
2025 J jnl
Class-based Subset Selection for Transfer Learning under Extreme Label Shift.
CoRR
Akul Goyal, Carl Edwards
2025 A* conf
Geometry Informed Tokenization of Molecules for Language Model Generation.
ICML
Xiner Li, Limei Wang, Youzhi Luo, Carl Edwards, Shurui Gui, Yuchao Lin, Heng Ji, Shuiwang Ji
2025 J jnl
Invariant Tokenization of Crystalline Materials for Language Model Enabled Generation.
CoRR
Keqiang Yan, Xiner Li, Hongyi Ling, Kenna Ashen, Carl Edwards, Raymundo Arróyave, Marinka Zitnik, Heng Ji, Xiaofeng Qian, Xiaoning Qian, Shuiwang Ji
2025 J jnl
mCLM: A Function-Infused and Synthesis-Friendly Modular Chemical Language Model.
CoRR
Carl Edwards, Chi Han, Gawon Lee, Thao Nguyen, Bowen Jin, Chetan Prasad, Sara Szymkuc, Bartosz A. Grzybowski, Ying Diao, Jiawei Han, Ge Liu, Hao Peng, Martin D. Burke, Heng Ji
2025 J jnl
oMeBench: Towards Robust Benchmarking of LLMs in Organic Mechanism Elucidation and Reasoning.
CoRR
Ruiling Xu, Yifan Zhang, Qingyun Wang, Carl Edwards, Heng Ji
2024 A* conf
CHEMREASONER: Heuristic Search over a Large Language Model's Knowledge Space using Quantum-Chemical Feedback.
ICML
Henry W. Sprueill, Carl Edwards, Khushbu Agarwal, Mariefel V. Olarte, Udishnu Sanyal, Conrad Johnston, Hongbin Liu, Heng Ji, Sutanay Choudhury
2024 J jnl
ChemReasoner: Heuristic Search over a Large Language Model's Knowledge Space using Quantum-Chemical Feedback.
CoRR
Henry W. Sprueill, Carl Edwards, Khushbu Agarwal, Mariefel V. Olarte, Udishnu Sanyal, Conrad Johnston, Hongbin Liu, Heng Ji, Sutanay Choudhury
2024 A conf
GLaD: Synergizing Molecular Graphs and Language Descriptors for Enhanced Power Conversion Efficiency Prediction in Organic Photovoltaic Devices.
CIKM
Thao Nguyen, Tiara Torres-Flores, Changhyun Hwang, Carl Edwards, Ying Diao, Heng Ji
2024 J jnl
GLaD: Synergizing Molecular Graphs and Language Descriptors for Enhanced Power Conversion Efficiency Prediction in Organic Photovoltaic Devices.
CoRR
Thao Nguyen, Tiara Torres-Flores, Changhyun Hwang, Carl Edwards, Ying Diao, Heng Ji
2024 J jnl
Geometry Informed Tokenization of Molecules for Language Model Generation.
CoRR
Xiner Li, Limei Wang, Youzhi Luo, Carl Edwards, Shurui Gui, Yuchao Lin, Heng Ji, Shuiwang Ji
2024 A* conf
Invariant Tokenization of Crystalline Materials for Language Model Enabled Generation.
NeurIPS
Keqiang Yan, Xiner Li, Hongyi Ling, Kenna Ashen, Carl Edwards, Raymundo Arróyave, Marinka Zitnik, Heng Ji, Xiaofeng Qian, Xiaoning Qian, Shuiwang Ji
2024 J jnl
L+M-24: Building a Dataset for Language + Molecules @ ACL 2024.
CoRR
Carl Edwards, Qingyun Wang, Lawrence Zhao, Heng Ji
2024 J jnl
MolCap-Arena: A Comprehensive Captioning Benchmark on Language-Enhanced Molecular Property Prediction.
CoRR
Carl Edwards, Ziqing Lu, Ehsan Hajiramezanali, Tommaso Biancalani, Heng Ji, Gabriele Scalia
2023 J jnl
Artificial Intelligence for Science in Quantum, Atomistic, and Continuum Systems.
CoRR
Xuan Zhang, Limei Wang, Jacob Helwig, Youzhi Luo, Cong Fu, Yaochen Xie, Meng Liu, Yuchao Lin, Zhao Xu, Keqiang Yan, Keir Adams, Maurice Weiler, Xiner Li, Tianfan Fu, Yucheng Wang, Haiyang Yu, Yuqing Xie, Xiang Fu, Alex Strasser, Shenglong Xu, Yi Liu, Yuanqi Du, Alexandra Saxton, Hongyi Ling, Hannah Lawrence, Hannes Stärk, Shurui Gui, Carl Edwards, Nicholas Gao, Adriana Ladera, Tailin Wu, Elyssa F. Hofgard, Aria Mansouri Tehrani, Rui Wang, Ameya Daigavane, Montgomery Bohde, Jerry Kurtin, Qian Huang, Tuong Phung, Minkai Xu, Chaitanya K. Joshi, Simon V. Mathis, Kamyar Azizzadenesheli, Ada Fang, Alán Aspuru-Guzik, Erik J. Bekkers, Michael M. Bronstein, Marinka Zitnik, Anima Anandkumar, Stefano Ermon, Pietro Liò, Rose Yu, Stephan Günnemann, Jure Leskovec, Heng Ji, Jimeng Sun, Regina Barzilay, Tommi S. Jaakkola, Connor W. Coley, Xiaoning Qian, Xiaofeng Qian, Tess E. Smidt, Shuiwang Ji
2023 — conf
Defining a New NLP Playground.
EMNLP (Findings)
Sha Li, Chi Han, Pengfei Yu, Carl Edwards, Manling Li, Xingyao Wang, Yi Ren Fung, Charles Yu, Joel R. Tetreault, Eduard H. Hovy, Heng Ji
2023 J jnl
Defining a New NLP Playground.
CoRR
Sha Li, Chi Han, Pengfei Yu, Carl Edwards, Manling Li, Xingyao Wang, Yi R. Fung, Charles Yu, Joel R. Tetreault, Eduard H. Hovy, Heng Ji
2023 — conf
Monte Carlo Thought Search: Large Language Model Querying for Complex Scientific Reasoning in Catalyst Design.
EMNLP (Findings)
Henry Sprueill, Carl Edwards, Mariefel V. Olarte, Udishnu Sanyal, Heng Ji, Sutanay Choudhury
2023 J jnl
Monte Carlo Thought Search: Large Language Model Querying for Complex Scientific Reasoning in Catalyst Design.
CoRR
Henry W. Sprueill, Carl Edwards, Mariefel V. Olarte, Udishnu Sanyal, Heng Ji, Sutanay Choudhury
2023 A conf
Semi-supervised New Event Type Induction and Description via Contrastive Loss-Enforced Batch Attention.
EACL
Carl Edwards, Heng Ji
2023 J jnl
SynerGPT: In-Context Learning for Personalized Drug Synergy Prediction and Drug Design.
CoRR
Carl Edwards, Aakanksha Naik, Tushar Khot, Martin D. Burke, Heng Ji, Tom Hope
2022 J jnl
Semi-supervised New Event Type Induction and Description via Contrastive Loss-Enforced Batch Attention.
CoRR
Carl Edwards, Heng Ji
2022 A* conf
Translation between Molecules and Natural Language.
EMNLP
Carl Edwards, Tuan Manh Lai, Kevin Ros, Garrett Honke, Kyunghyun Cho, Heng Ji
2022 J jnl
Translation between Molecules and Natural Language.
CoRR
Carl Edwards, Tuan Manh Lai, Kevin Ros, Garrett Honke, Heng Ji
2021 — conf
Team Skeletor at Touché 2021: Argument Retrieval and Visualization for Controversial Questions.
CLEF (Working Notes)
Kevin Ros, Carl Edwards, Heng Ji, ChengXiang Zhai
2021 — conf
Text2Mol: Cross-Modal Molecule Retrieval with Natural Language Queries.
EMNLP (1)
Carl Edwards, ChengXiang Zhai, Heng Ji