Session 4: AI Chemistry and Theoretical Chemistry

AI Chemistry and Theoretical Chemistry


Chairman:


史强.png江剑.png张文彬.png刘剑.png
Qiang ShiJian JiangWenbin ZhangJian Liu
ICCASICCASPKUPKU


Contact:

Shuming Bai,  baishuming@iccas.ac.cn


Session Topics

This session focuses on data-driven and AI-driven research in chemical theory and mechanisms, as well as the latest developments in theoretical and computational chemistry. Theoretical and computational chemistry are essential tools in molecular science research, and data-driven and AI-driven approaches are rapidly emerging as new paradigms in chemistry research. The symposium aims to promote the integration of theoretical chemistry and artificial intelligence, driving transformation in related research paradigms. We invite submissions covering a wide range of topics, including AI-driven chemistry, electronic structure methods, chemical dynamics, statistical mechanics, and polymer physics. The symposium will feature a combination of invited talks and poster presentations, and we warmly welcome contributions from experts and scholars in the fields of theoretical chemistry and AI chemistry.


Speakers


Zlatko Bačić.pngjianshu Cao.png陈立朋.png程俊.png




Zlatko BačićJianshu CaoLipeng ChenJun Cheng
New York UniversityMassachusetts Institute of TechnologyZhejiang LabXiamen University




Yuan-Chung Cheng郑原忠.png崔刚龙.png董际臣.pngPavlo Dral.png




Yuan-Chung ChengGanglong CuiJichen DongPavlo Dral
National Taiwan UniversityBeijing Normal University

Institute of Chemistry,

 Chinese Academy of Sciences

Xiamen University




高寒宇.pngJiali Gao.pngMaxim Gelin.png洪亮.png




Hanyu GaoJiali GaoMaxim GelinLiang Hong

The Hong Kong University of 

Science and Technology

University of MinnesotaHangzhou Dianzi UniversityShanghai Jiao Tong University




Akihito Ishizaki.png江俊.png李剑锋.png黎书华.png




Akihito IshizakiJun JiangJianfeng LiShuhua Li
University of Tokyo

University of Science and

 Technology of China

Fudan UniversityNanjing University




Ying Li.png林嘉平.png刘文剑.pngEli Pollak.png




Ying LiJiaping LinWenjian LiuEli Pollak
University of Wisconsin-Madison

East China University of 

Science and Technology

Shandong UniversityWeizmann Institute of Science




Young Min Rhee.pngChang Yun Son.png孙昭艳.png索兵兵.png




Young Min RheeChang Yun SonZhaoyan SunBingbing Suo
KAISTSeoul National University

Changchun Institute of Applied Chemistry, 

Chinese Academy of Sciences

Northwest University




Seiichiro Ten-no.pngMark Tuckerman.png燕立唐.png易院平.png




Seiichiro Ten-noMark TuckermanLitang YanYuanping Yi
Kobe UniversityNew York UniversityTsinghua University

Institute of Chemistry,

 Chinese Academy of Sciences





张林峰.pngChaoyuan Zhu.png




Linfeng ZhangChaoyuan Zhu
DP TechnologyNational Chiao Tung University


COUNTING TIME

Important Dates

Deadline for Registration

April 15, 2025


Deadline for Abstract Submission

April 15, 2025


Conference Held

May 16–18, 2025

Organization