Portrait of Jian Tang

Jian Tang

Core Academic Member
Canada CIFAR AI Chair
Associate Professor, HEC Montréal, Department of Decision Sciences
Adjunct Professor, Université de Montréal, Department of Computer Science and Operations Research
Founder, BioGeometry
Research Topics
Computational Biology
Deep Learning
Generative Models
Graph Neural Networks
Molecular Modeling

Biography

Jian Tang is an Associate professor at HEC's Department of Decision Sciences. He is also an Adjunct professor at the Department of Computer Science and Operations Research at University of Montreal and a Core Academic member at Mila - Quebec AI Institute. He is a Canada CIFAR AI Chair and the Founder of BioGeometry, an AI startup that focuses on generative AI for antibody discovery. Tang’s main research interests are deep generative models and graph machine learning, and their applications to drug discovery. He is an international leader in graph machine learning, and LINE, his node representation method, has been widely recognized and cited more than five thousand times. He has also done pioneering work on AI for drug discovery, such as developing the first open-source machine learning frameworks for drug discovery, TorchDrug and TorchProtein.

Current Students

Collaborating researcher
PhD - Université de Montréal
Principal supervisor :
PhD - Université de Montréal
Collaborating researcher - Carnegie Mellon University
PhD - Université de Montréal
PhD - Université de Montréal
Principal supervisor :
PhD - Université de Montréal
PhD - Université de Montréal
PhD - Université de Montréal
PhD - Université de Montréal

Publications

Author Correction: Isospin competitions and valley polarized correlated insulators in twisted double bilayer graphene
Le Liu
Shihao Zhang
Yanbang Chu
Cheng Shen
Yuan Huang
Yalong Yuan
Jinpeng Tian
Yiru Ji
Rong Yang
Kenji Watanabe
Takashi Taniguchi
Dongxia Shi
Jianpeng Liu
Wei Yang
Guangyu Zhang
Fully-inductive Node Classification on Arbitrary Graphs
Jianan Zhao
Hesham Mostafa
Mikhail Galkin
Michael M. Bronstein
Zhaocheng Zhu
GlycanML: A Multi-Task and Multi-Structure Benchmark for Glycan Machine Learning
Minghao Xu
Yunteng Geng
Yihan Zhang
Ling Yang
Wentao Zhang
Glycans are basic biomolecules and perform essential functions within living organisms. The rapid increase of functional glycan data provide… (see more)s a good opportunity for machine learning solutions to glycan understanding. However, there still lacks a standard machine learning benchmark for glycan property and function prediction. In this work, we fill this blank by building a comprehensive benchmark for Glycan Machine Learning (GlycanML). The GlycanML benchmark consists of diverse types of tasks including glycan taxonomy prediction, glycan immunogenicity prediction, glycosylation type prediction, and protein-glycan interaction prediction. Glycans can be represented by both sequences and graphs in GlycanML, which enables us to extensively evaluate sequence-based models and graph neural networks (GNNs) on benchmark tasks. Furthermore, by concurrently performing eight glycan taxonomy prediction tasks, we introduce the GlycanML-MTL testbed for multi-task learning (MTL) algorithms. Also, we evaluate how taxonomy prediction can boost other three function prediction tasks by MTL. Experimental results show the superiority of modeling glycans with multi-relational GNNs, and suitable MTL methods can further boost model performance. We provide all datasets and source codes at https://github.com/GlycanML/GlycanML and maintain a leaderboard at https://GlycanML.github.io/project
Structure Language Models for Protein Conformation Generation
Jiarui Lu
Xiaoyin Chen
Stephen Zhewen Lu
Chence Shi
Hongyu Guo
JUNO sensitivity to invisible decay modes of neutrons
Juno Collaboration Angel Abusleme
Angel Abusleme
Thomas Adam
Kai Adamowicz
Shakeel Ahmad
Rizwan Ahmed
Sebastiano Aiello
Fengpeng An
Qi An
Giuseppe Andronico
Nikolay Anfimov
Vito Antonelli
Tatiana Antoshkina
João Pedro Athayde Marcondes de André
Didier Auguste
Weidong Bai
Nikita Balashov
Wander Baldini
Andrea Barresi
Davide Basilico … (see 669 more)
Eric Baussan
Marco Bellato
Marco Beretta
Antonio Bergnoli
Daniel Bick
Lukas Bieger
Svetlana Biktemerova
Thilo Birkenfeld
Iwan Blake
Simon Blyth
Anastasia Bolshakova
Mathieu Bongrand
Dominique Breton
Augusto Brigatti
Riccardo Brugnera
Riccardo Bruno
Antonio Budano
Jose Busto
Anatael Cabrera
Barbara Caccianiga
Hao Cai
Xiao Cai
Yanke Cai
Zhiyan Cai
Zucong Cai
Stéphane Callier
Steven Calvez
Antonio Cammi
Agustin Campeny
Chuanya Cao
C. Cao
Guofu Cao
Jun Cao
Rossella Caruso
Cédric Cerna
Vanessa Cerrone
Jinfan Chang
Yun Chang
Auttakit Chatrabhuti
Chao Chen
Guoming Chen
Pingping Chen
Shaomin Chen
Xin Chen
Yiming Chen
Yixue Chen
Yu Chen
Zelin Chen
Zhangming Chen
Zhiyuan Chen
Zikang Chen
Jie Cheng
Yaping Cheng
Yu Chin Cheng
Yuanyuan Zhang
Alexander Chepurnov
Alexey Chetverikov
Davide Chiesa
Pietro Chimenti
Yen-Ting Chin
Po-Lin Chou
Ziliang Chu
Artem Chukanov
Gérard Claverie
Catia Clementi
Barbara Clerbaux
Marta Colomer Molla
Selma Conforti Di Lorenzo
Alberto Coppi
Daniele Corti
Simon Csakli
Chenyang Cui
Flavio Dal Corso
Olivia Dalager
Jaydeep Datta
Christophe De La Taille
C. Taille
Zhi Deng
Ziyan Deng
Xiaoyu Ding
Xuefeng Ding
Yayun Ding
Bayu Dirgantara
Carsten Dittrich
Sergey Dmitrievsky
Tadeas Dohnal
Dmitry Dolzhikov
Georgy Donchenko
Jianmeng Dong
Evgeny Doroshkevich
Wei Dou
Marcos Dracos
Frédéric Druillole
Ran Du
S. X. Du
Shuxian Du
Yujie Duan
Katherine Dugas
K. Dugas
Stefano Dusini
Hongyue Duyang
Jessica Eck
J. Eck
Timo Enqvist
Andrea Fabbri
Ulrike Fahrendholz
Lei Fan
Jian Fang
Wenxing Fang
Dmitry Fedoseev
Haiping Peng
Li-Cheng Feng
Qichun Feng
Federico Ferraro
Amélie Fournier
Fritsch Fritsch
Haonan Gan
Feng Gao
Alberto Garfagnini
Arsenii Gavrikov
Marco Giammarchi
Nunzio Giudice
Maxim Gonchar
G. Gong
Hui Gong
Guanghua Gong
Yuri Gornushkin
Marco Grassi
Maxim Gromov
Vasily Gromov
Minghao Gu
Xiang Gu
Xiaofei Gu
Yunting Gu
M. Guan
Yu Gu
Mengyun Guan
Yuduo Guan
Nunzio Guardone
Rosa Maria Guizzetti
Cong Guo
Wanlei Guo
Caren Hagner
Hechong Han
Ran Han
Yang Han
Jinhong He
Miao He
Wei He
Xinhai He
Tobias Heinz
Patrick Hellmuth
Yuekun Heng
Rafael Herrera
Yuenkeung Hor
Shaojing Hou
Yee Hsiung
Bei-Zhen Hu
Hang Hu
Jun Hu
Peng Hu
Shouyang Hu
Tao Hu
Yuxiang Hu
Zhuojun Hu
Guihong Huang
Hanxiong Huang
Jinhao Huang
Jun-Hao Huang
Junting Huang
Kaixuan Huang
Shengheng Huang
Wenhao Huang
Xingtao Huang
Xin Huang
Yongbo Huang
Jiaqi Hui
Lei Huo
Wenju Huo
Cédric Huss
Safeer Hussain
Leonard Imbert
Ara Ioannisian
Roberto Isocrate
Arshak Jafar
Beatrice Jelmini
Ignacio Jeria
Xiaolu Ji
Huihui Jia
Junji Jia
Siyu Jian
Cailian Jiang
Di Jiang
Guangzheng Jiang
Wei Jiang
Xiaoshan Jiang
Xiaozhao Jiang
Yixuan Jiang
Xiang Jing
Xiaoping Jing
Cécile Jollet
Li Kang
Rebin Karaparabil
Narine Kazarian
Ali Khan
Amina Khatun
Khanchai Khosonthongkee
Denis Korablev
Konstantin Kouzakov
Alexey Krasnoperov
Sergey Kuleshov
S. Kumaran
Sindhujha Kumaran
Nikolay Kutovskiy
Loïc Labit
Tobias Lachenmaier
Haojing Lai
Cecilia Landini
Sébastien Leblanc
Frederic Lefevre
Rui Li
Rupert Leitner
Jason Leung
Demin Li
Yi Wang
Fule Li
Fei Li
Gaosong Li
Hongjian Li
Huang Li
Jiajun Li
Min Li
Nan Li
Qingjiang Li
Ruhui Li
Ruiting Lei
Shanfeng Li
Shuo Li
Tao Li
Teng Li
Weidong Li
Weiguo Li
Xiaomei Li
Xiaonan Li
Xinglong Li
Yi Li
Yichen Li
Yufeng Li
Zhaohan Li
Zhibing Li
Ziyuan Li
Zonghai Li
An-An Liang
Hao Liang
Jiaming Yan
Yilin Liao
Jiajun Liao
Y. P. Liao
Ayut Limphirat
Yuzhong Liao
Guey-Lin Lin
Shengxin Lin
Tao Lin
Jiajie Ling
Xin Ling
Ivano Lippi
Caimei Liu
Yang Liu
Fengcheng Liu
Haidong Liu
Haotian Liu
Hongbang Liu
Hongjuan Liu
Hongtao Liu
Hongyang Liu
Jianglai Liu
Jiaxi Liu
Jinchang Liu
Min Liu
Qian Liu
Qin Liu
Runxuan Liu
Shenghui Liu
Shubin Liu
Shulin Liu
Xiaowei Liu
Xiwen Liu
Xuewei Liu
Yankai Liu
Zhen Liu
Lorenzo Loi
Alexey Lokhov
Paolo Lombardi
Claudio Lombardo
Kai Loo
Chuan Lu
Haoqi Lu
Jingbin Lu
Junguang Lu
Meishu Lu
Peizhi Lu
Shuxiang Lu
Xianguo Lu
Bayarto Lubsandorzhiev
Sultim Lubsandorzhiev
Livia Ludhova
Arslan Lukanov
F. Luo
Guang Luo
Fengjiao Luo
Jianyi Luo
Shu Luo
Wuming Luo
Xiaojie Luo
Vladimir Lyashuk
Biao Ma
Bing Ma
Qiumei Ma
Bangzheng Ma
Si Ma
Xiaoyan Ma
Xubo Ma
Jihane Maalmi
Jingyu Mai
Marco Malabarba
Yury Malyshkin
Roberto Carlos Mandujano
Fabio Mantovani
Xin Mao
Yajun Mao
S. Mari
Filippo Marini
Stefano M. Mari
Agnese Martini
Matthias Mayer
Davit Mayilyan
Ints Mednieks
Yu Meng
Anita Meraviglia
Anselmo Meregaglia
Emanuela Meroni
Lino Miramonti
Nikhil Mohan
Michele Montuschi
Cristobal Morales Reveco
M. Nastasi
Dmitry V. Naumov
Massimiliano Nastasi
Elena Naumova
Diana Navas-Nicolas
Igor Nemchenok
Minh Thuan Nguyen Thi
Alexey Nikolaev
F. Ning
Zhe Ning
Feipeng Ning
Hiroshi Nunokawa
Lothar Oberauer
Juan Pedro Ochoa-Ricoux
Alexander Olshevskiy
Domizia Orestano
Fausto Ortica
Rainer Othegraven
A. Paoloni
George Parker
Alessandro Paoloni
Sergio Parmeggiano
Achilleas Patsias
Y. P. Pei
Luca Pelicci
Yatian Pei
Anguo Peng
Yu Peng
Yuefeng Peng
Zhaoyuan Peng
Elisa Percalli
Willy Perrin
Frédéric Perrot
P. Petitjean
Fabrizio Petrucci
Pierre-Alexandre Petitjean
Oliver Pilarczyk
Luis Felipe Piñeres Rico
Artyom Popov
Pascal Poussot
Ezio Previtali
Fazhi Qi
Ming Qi
Xiaohui Qi
Sen Qian
X. Qian
Zhen Qian
Hao Qiao
Xiaohui Qian
Zhonghua Qin
S. Qiu
Manhao Qu
Shoukang Qiu
Z. Qu
Gioacchino Ranucci
Zhenning Qu
A. Re
Abdel Rebii
Alessandra Re
Mariia Redchuk
Gioele Reina
Bin Ren
Jie Ren
Yuhan Ren
Barbara Ricci
Komkrit Rientong
Mariam Rifai
Mathieu Roche
Narongkiat Rodphai
Aldo Romani
Bedřich Roskovec
Xichao Ruan
Arseniy Rybnikov
Andrey Sadovsky
Paolo Saggese
Deshan Sandanayake
Anut Sangka
G. Sava
Utane Sawangwit
Giuseppe Sava
Michaela Schever
Cédric Schwab
Konstantin Schweizer
Alexandr Selyunin
Andrea Serafini
M. Settimo
Junyu Shao
Mariangela Settimo
V. Sharov
Hexi Shi
Vladislav Sharov
Jingyan Shi
Yanan Shi
Vitaly Shutov
Andrey Sidorenkov
Fedor Šimkovic
Apeksha Singhal
Chiara Sirignano
Jaruchit Siripak
Monica Sisti
Mikhail Smirnov
Oleg Smirnov
Sergey Sokolov
Julanan Songwadhana
Boonrucksar Soonthornthum
Albert Sotnikov
Warintorn Sreethawong
Achim Stahl
Luca Stanco
Konstantin Stankevich
Hans Steiger
Jochen Steinmann
Tobias Sterr
M. Stock
Virginia Strati
Matthias Raphael Stock
Michail Strizh
Alexander Studenikin
Aoqi Su
Jun Su
G. X. Sun
Shifeng Sun
Xilei Sun
Yongjie Sun
Guangbao Sun
Yongzhao Sun
Zhengyang Sun
Narumon Suwonjandee
Akira Takenaka
Xiaohan Tan
Jing-Yu Tang
Qiang Tang
Quan Tang
Jingzhe Tang
Xiao Tang
Vidhya Thara Hariharan
Igor Tkachev
Tomas Tmej
M. Torri
Andrea Triossi
Wladyslaw Trzaska
Marco Danilo Claudio Torri
Y. Tung
Cristina Tuve
Nikita Ushakov
Vadim Vedin
Yu-Chen Tung
Carlo Venettacci
Giuseppe Verde
Maxim Vialkov
Benoit Viaud
Cornelius Moritz Vollbrecht
Katharina von Sturm
Vit Vorobel
Dmitriy Voronin
Lucia Votano
Pablo Walker
Caishen Wang
Chung-Hsiang Wang
En Wang
Guoli Wang
Y. H. Wang
Jian Wang
Jun Wang
Li Wang
Lucinda W. Wang
Meng Wang
Mingyuan Wang
Qianchuan Wang
Lu Wang
Ruiguang Wang
Sibo Wang
Siguang Wang
Wei Wang
Wenshuai Wang
Xi Wang
Xiangyue Wang
Yangfu Wang
Yaoguang Wang
Yifang Wang
Yuanqing Wang
Yuyi Wang
Zhe Wang
Zheng Wang
Zhimin Wang
Apimook Watcharangkool
Wei Wei
Wenlu Wei
Yadong Wei
Yuehuan Wei
Liangjian Wen
Jun Weng
Christopher Wiebusch
Rosmarie Wirth
Chengxin Wu
Diru Wu
Qun Wu
Yinhui Wu
Yiyang Wu
Zhi Wu
Michael Wurm
Jacques Wurtz
Christian Wysotzki
Yufei Xi
Dongmei Xia
Shishen Xian
Ziqian Xiang
Fei Xiao
Xiang Xiao
Xiaochuan Xie
Yijun Xie
Yuguang Xie
Zhao Xin
Zhizhong Xing
Benda Xu
Cheng Xu
Donglian Xu
Fanrong Xu
Hangkun Xu
Jiayang Xu
Jilei Xu
Jing Xu
Jinghuan Xu
Meihang Xu
Xunjie Xu
Yin Xu
Yu Xu
Baojun Yan
Qiyu Yan
Taylor Yan
Xiongbo Yan
Yupeng Yan
Changgen Yang
Chengfeng Yang
Fengfan Yang
Jie Yang
Lei Yang
Pengfei Yang
Xiaoyu Yang
Yifan Yang
Yixiang Yang
Zekun Yang
Haifeng Yao
Jiaxuan Ye
Mei Ye
Ziping Ye
Frédéric Yermia
Zhengyun You
Boxiang Yu
Chiye Yu
Chunxu Yu
Guojun Yu
Hongzhao Yu
Miao Yu
Xianghui Yu
Zeyuan Yu
Zezhong Yu
Cenxi Yuan
Chengzhuo Yuan
Zhenxiong Yuan
Baobiao Yue
Noman Zafar
Kirill Zamogilnyi
Vitalii Zavadskyi
Fanrui Zeng
Shan Zeng
Tingxuan Zeng
Yuda Zeng
Liang Zhan
Aiqiang Zhang
Bin Zhang
Binting Zhang
Feiyang Zhang
Hangchang Zhang
Haosen Zhang
Honghao Zhang
Jiawen Zhang
Jie Zhang
Jingbo Zhang
Jinnan Zhang
Junwei Zhang
Lei Zhang
Peng Zhang
Ping Zhang
Qingmin Zhang
Shiqi Zhang
Shu Zhang
Shuihan Zhang
Siyuan Zhang
Tao Zhang
Xiaomei Zhang
Xin Zhang
Xuantong Zhang
Yibing Zhang
Yinhong Zhang
Yiyu Zhang
Yongpeng Zhang
Yu Zhang
Yumei Zhang
Zhenyu Zhang
Zhijian Zhang
Jie Zhao
Rong Zhao
Runze Zhao
Shujun Zhao
Tianhao Zhao
Hua Zheng
Yangheng Zheng
Jing Zhou
Li Zhou
Nan Zhou
Shun Zhou
Tong Zhou
Xiang Zhou
Xing Zhou
Jingsen Zhu
Kangfu Zhu
Kejun Zhu
Zhihang Zhu
Bo Zhuang
Honglin Zhuang
Liang Zong
Jiaheng Zou
Medium-scale flexible integrated circuits based on 2D semiconductors
Yalin Peng
Chenyang Cui
Lu Liu
Yuchen Wang
Qinqin Wang
Jinpeng Tian
Zhiheng Huang
Biying Huang
Yangkun Zhang
Xiuzhen Li
Yanbang Chu
Wei Yang
Dongxia Shi
Luojun Du
Na Li
Guangyu Zhang
Sliding ferroelectric memories and synapses based on rhombohedral-stacked bilayer MoS2
Xiuzhen Li
Biao Qin
Yaxian Wang
Yue Xi
Zhiheng Huang
Mengze Zhao
Yalin Peng
Zitao Chen
Zitian Pan
Jundong Zhu
Chenyang Cui
Rong Yang
Wei Yang
Sheng Meng
Dongxia Shi
Xuedong Bai
Can Liu
Na Li
Kaihui Liu … (see 3 more)
Kai-Wen Liu
Luojun Du
Guangyu Zhang
The design and technology development of the JUNO central detector
Angel Abusleme
Thomas Adam
Shakeel Ahmad
Rizwan Ahmed
Sebastiano Aiello
Muhammad Akram
Abid Aleem
Tsagkarakis Alexandros
Fengpeng An
Qi An
Giuseppe Andronico
Nikolay Anfimov
Vito Antonelli
Tatiana Antoshkina
Burin Asavapibhop
J. D. de André
João Pedro Athayde Marcondes de André
Didier Auguste
Weidong Bai
Nikita Balashov … (see 615 more)
Wander Baldini
Andrea Barresi
Davide Basilico
Eric Baussan
Marco Bellato
Marco Beretta
Antonio Bergnoli
Daniel Bick
Thilo Birkenfeld
David Blum
Simon Blyth
Anastasia Bolshakova
Mathieu Bongrand
Clément Bordereau
Dominique Breton
Augusto Brigatti
Riccardo Brugnera
Riccardo Bruno
Antonio Budano
Jose Busto
Anatael Cabrera
Barbara Caccianiga
Hao Cai
Xiao Cai
Yanke Cai
Zhiyan Cai
Zucong Cai
Stéphane Callier
Antonio Cammi
Agustin Campeny
Chuanya Cao
C. Cao
Guofu Cao
Jun Cao
Rossella Caruso
Cédric Cerna
Vanessa Cerrone
Chi Chan
Jinfan Chang
Yun Chang
Guoming Chen
Pingping Chen
Shaomin Chen
Yixue Chen
Yu Chen
Zhiyuan Chen
Zikang Chen
Jie Cheng
Yaping Cheng
Yu Chin Cheng
Yuanyuan Zhang
Alexander Chepurnov
Alexey Chetverikov
Davide Chiesa
Pietro Chimenti
Ziliang Chu
Artem Chukanov
Gérard Claverie
Catia Clementi
Barbara Clerbaux
Marta Colomer Molla
Selma Conforti Di Lorenzo
Alberto Coppi
Daniele Corti
Flavio Dal Corso
Olivia Dalager
Christophe De La Taille
Zhi Deng
Ziyan Deng
Wilfried Depnering
Marco Diaz
Xuefeng Ding
Yayun Ding
Bayu Dirgantara
Sergey Dmitrievsky
Tadeas Dohnal
Dmitry Dolzhikov
Georgy Donchenko
Jianmeng Dong
Evgeny Doroshkevich
Wei Dou
Marcos Dracos
Frédéric Druillole
Ran Du
S. X. Du
Shuxian Du
Stefano Dusini
Hongyue Duyang
Timo Enqvist
Andrea Fabbri
Ulrike Fahrendholz
Lei Fan
Jian Fang
Wenxing Fang
Marco Fargetta
Dmitry Fedoseev
Zhengyong Fei
Li-Cheng Feng
Qichun Feng
Federico Ferraro
Amélie Fournier
H. Gan
Haonan Gan
Feng Gao
Alberto Garfagnini
Arsenii Gavrikov
Marco Giammarchi
Nunzio Giudice
Maxim Gonchar
Guanghua Gong
Hui Gong
Yuri Gornushkin
Alexandre Göttel
A. Gottel
Marco Grassi
Maxim Gromov
Vasily Gromov
Minghao Gu
Xiaofei Gu
Xiang Gu
Yu Gu
Yunting Gu
Mengyun Guan
M. Guan
Yuduo Guan
Nunzio Guardone
Cong Guo
Wanlei Guo
Xinheng Guo
Yuhang Guo
Caren Hagner
Ran Han
Yang Han
Jiajun Hao
Miao He
Wei He
Tobias Heinz
Patrick Hellmuth
Yuekun Heng
Rafael Herrera
Yuenkeung Hor
Shaojing Hou
Yee Hsiung
Bei-Zhen Hu
Hang Hu
Jianrun Hu
Jun Hu
Shouyang Hu
Tao Hu
Yuxiang Hu
Zhuojun Hu
Guihong Huang
Hanxiong Huang
Kaixi Huang
Kaixuan Huang
Wenhao Huang
Xin Huang
Xingtao Huang
Yongbo Huang
Jiaqi Hui
Lei Huo
Wenju Huo
Cédric Huss
Safeer Hussain
Ara Ioannisian
Roberto Isocrate
Beatrice Jelmini
Ignacio Jeria
Xiaolu Ji
Huihui Jia
Junji Jia
Siyu Jian
Di Jiang
Wei Jiang
Xiaoshan Jiang
Xiaoping Jing
Xiang Jing
Cécile Jollet
Philipp Kampmann
Li Kang
Rebin Karaparambil
Narine Kazarian
Ali Khan
Amina Khatun
Khanchai Khosonthongkee
Denis Korablev
Konstantin Kouzakov
Alexey Krasnoperov
Nikolay Kutovskiy
Pasi Kuusiniemi
Tobias Lachenmaier
Cecilia Landini
Sébastien Leblanc
Victor Lebrin
Frederic Lefevre
Rui Li
Rupert Leitner
Jason Leung
Daozheng Li
Demin Li
Fei Li
Yi Wang
Fule Li
Gaosong Li
Huiling Li
Mengzhao Li
Min Li
Nan Li
Qingjiang Li
Ruhui Li
Ruiting Lei
Shanfeng Li
Tao Li
Teng Li
Weidong Li
Weiguo Li
Xiaomei Li
Xiaonan Li
Xinglong Li
Xiwen Li
Yi Li
Yichen Li
Yufeng Li
Zepeng Li
Zhaohan Li
Zhibing Li
Ziyuan Li
Zonghai Li
Hao Liang
Jiaming Yan
Jiajun Liao
Ayut Limphirat
Guey-Lin Lin
Shengxin Lin
Tao Lin
Jiajie Ling
Ivano Lippi
Caimei Liu
Yang Liu
Haidong Liu
Haotian Liu
Hongbang Liu
Hongjuan Liu
Hongtao Liu
Hui Liu
Jianglai Liu
Jinchang Liu
Min Liu
Qian Liu
Qin Liu
Runxuan Liu
Shubin Liu
Shulin Liu
Xiaowei Liu
Xiwen Liu
Yong Liu
Yunzhe Liu
Alexey Lokhov
Paolo Lombardi
Claudio Lombardo
Kai Loo
Chuan Lu
Haoqi Lu
Jingbin Lu
Junguang Lu
Peizhi Lu
Shuxiang Lu
Bayarto Lubsandorzhiev
Sultim Lubsandorzhiev
Livia Ludhova
Arslan Lukanov
Daibin Luo
F. Luo
Fengjiao Luo
Guang Luo
Jianyi Luo
Shu Luo
Wuming Luo
Xiaojie Luo
Xiaolan Luo
Vladimir Lyashuk
Biao Ma
Bing Ma
Bangzheng Ma
R. Q. Ma
Si Ma
Qiumei Ma
Xiaoyan Ma
Xubo Ma
Jihane Maalmi
Marco Magoni
Jingyu Mai
Yury Malyshkin
Roberto Carlos Mandujano
Fabio Mantovani
Xin Mao
Yajun Mao
S. Mari
Stefano M. Mari
Filippo Marini
Agnese Martini
Matthias Mayer
Davit Mayilyan
Ints Mednieks
Yu Meng
Anita Meraviglia
Anselmo Meregaglia
Emanuela Meroni
David Meyhöfer
Mauro Mezzetto
Lino Miramonti
Paolo Montini
Michele Montuschi
Axel Muller
M. Nastasi
Massimiliano Nastasi
Dmitry V. Naumov
Elena Naumova
Diana Navas-Nicolas
Igor Nemchenok
Minh Thuan Nguyen Thi
Alexey Nikolaev
F. Ning
Feipeng Ning
Zhe Ning
Hiroshi Nunokawa
Lothar Oberauer
Juan Pedro Ochoa-Ricoux
Alexander Olshevskiy
Domizia Orestano
Fausto Ortica
Rainer Othegraven
A. Paoloni
Alessandro Paoloni
Sergio Parmeggiano
Y. P. Pei
Yatian Pei
Luca Pelicci
Anguo Peng
Yu Peng
Haiping Peng
Yuefeng Peng
Z-R Peng
Frédéric Perrot
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Kejun Zhu
Zhihang Zhu
Bo Zhuang
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Liang Zong
Jiaheng Zou
Sebastian Zwickel
Correction: CEPC Technical Design Report: Accelerator
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Tiago CarlosAdorno de Freitas
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Abid Aleem
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D. Anderle
Stefan Antusch
Yasuo Arai
Andrej Arbuzov
Abdesslam Arhrib
A. Arhrib
Mustafa Ashry
Sha Bai … (see 1079 more)
Yu Bai
Yang Bai
Vipul Bairathi
Csaba Balazs
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Shou-Shan Bao
Desmond P. Barber
Ays¸e Bat
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Subash Chandra Behera
Alexander Belyaev
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Xiao-Jun Bi
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Michela Biglietti
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Deng Binglin
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Anton Bogomyagkov
Serge Bondarenko
Stewart Boogert
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Marcello Borri
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Angelo Bosotti
Vincent Boudry
Mohammed Boukidi
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Yijian Cai
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Yuchen Cai
Haiying Cai
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Lorenzo Calibbi
Junsong Cang
Guofu Cao
Jianshe Cao
Antoine Chance
Xuejun Chang
Yue Chang
Zhe Chang
Xinyuan Chang
Wei Chao
Auttakit Chatrabhuti
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Bin Chen
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Gang Chen
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Ji-Yuan Chen
Kai Chen
Mali Chen
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Mingshui Chen
Ning Chen
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Shanzhen Chen
Shao-Long Chen
Shaomin Chen
Shiqiang Chen
Tianlu Chen
Wei Chen
Xiang Chen
Xiaoyu Chen
Xin Chen
Xun Chen
Xurong Chen
Ye Chen
Ying Chen
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Zelin Chen
Zilin Chen
Boping Chen
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Shan Cheng
Tongguang Cheng
Yunlong Chi
Pietro Chimenti
Wen Han Chiu
Guk Cho
Mingxing Chu
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X. Chu
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Ziliang Chu
Guglielmo Coloretti
Andreas Crivellin
Hanhua Cui
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Ling-Yun Dai
Xinchen Dai
Xuwen Dai
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Christophe De La Taille
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Yu Gao
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Yun Guo
Zhi-Hui Guo
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Seungkyu Ha
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Francois Hammer
Chengcheng Han
Huayong Han
Jifeng Han
Liangliang Han
Liang Han
Rao Zhang
Yang Han
Ruixiong Han
Yezi Han
Yuanying Han
Tao Han
Jiankui Hao
Xiqing Hao
Qiang Zhao
Chuanqi He
Dayong He
Dongbing He
Guangyuan He
Hong-Jian He
Jibo He
Jun He
Longyan He
Xiang He
Xiao-Gang He
Zhenqiang He
Klaus Heinemann
Sven Heinemeyer
Yuekun Heng
María A. Herna´ndez-Ruíz
Jiamin Hong
Yuenkeung Hor
George W. S. Hou
Xiantao Hou
Xiaonan Hou
Zhilong Hou
Suen Hou
Caishi Hu
Chen Hu
Dake Hu
Haiming Hu
Jiagen Hu
Jun Hu
Kun Hu
Shouyang Hu
Yongcai Hu
Yu Hu
Zhen Hu
Z. Hua
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Chao-Shang Huang
Fa Peng Huang
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Jinshu Huang
Ke Huang
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Xingtao Huang
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Jiaqi Hui
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Kyuyeong Hwang
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Haeun Jang
Seoyun Jang
Daheng Ji
Q. Ji
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Quan Ji
Xiaolu Ji
Jingguang Jia
Jinsheng Jia
X. Q. Jia
Xuewei Jia
Zihang Jia
Cailian Jiang
Han Ren Jiang
Houbing Jiang
Jun Jiang
Xiaowei Jiang
Xin Jiang
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Sunghoon Jung
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KhanchaiKhosonthongkee
Bobae Kim
Dongwoon Kim
Mi Ran Kim
Minsuk Kim
Sungwon Kim
On Kim
Michael Klasen
Sanghyun Ko
S. Ko
Ivan Koop
Vitaliy Kornienko
Bryan Kortman
Gennady Kozlov
Shiqing Kuang
Mukesh Kumar
Chia Ming Kuo
Tsz Hong Kwok
Franc¸ois Sylvain Ren Lagarde
F. Lagarde
Pei-Zhu Lai
Imad Laktineh
Xiaofei Lan
Zuxiu Lan
Lia Lavezzi
Justin Lee
Junghyun Lee
Sehwook Lee
Ge Lei
Roy Lemmon
Yongxiang Leng
Sze Ching Leung
Hai Tao Li
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Bo Li
Changhong Li
Chao Li
Cheng Li
Chunhua Li
Cui Li
Dazhang Li
Dikai Li
Yi Wang
Gang Li
Gaosong Li
Haibo Li
Haifeng Li
Hai-Jun Li
Haotian Li
Hengne Li
Honglei Li
Huijing Li
Jialin Li
Jingyi Li
Jian Li
Jun Li
Leyi Li
Liang Li
Jinmian Li
Mei Li
Meng Li
Minxian Li
Ling Li
Pei-Rong Li
Qiang Li
Shaopeng Li
Shenghe Li
Shu Li
Shuo Li
Teng Li
Tiange Li
Tong Li
Weichang Li
Weidong Li
Wenjun Li
Xiaoling Li
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Xiaoting Li
Xin Li
Xinqiang Li
Xuekang Li
Yang Li
Yanwei Li
Yiming Li
Ying Li
Ying-Ying Li
Yonggang Li
Yonglin Li
Yufeng Li
Yuhui Li
Zhan Li
Zhao Li
Zhiji Li
Lingfeng Li
Jing Liang
Jinhan Liang
Zhijun Liang
Guangrui Liao
Hean Liao
Jiaming Yan
Fei Li
Libo Liao
Longzhou Liao
Yipu Liao
Ayut Limphirat
AyutLimphirat
Jiajun Liao
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Weiping Lin
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Yugen Lin
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Bo Liu
Danning Liu
Dong Liu
Fu-Hu Liu
Hongbang Liu
Huangcheng Liu
Hui Liu
Huiling Liu
Jia Liu
Jiaming Liu
Jianbei Liu
Jianyi Liu
Jingdong Liu
Jinhua Liu
Kai Liu
Kang Liu
Kun Liu
Mengyao Liu
Pengcheng Liu
Qibin Liu
Shan Liu
Shidong Liu
Shuang Liu
Shubin Liu
Peng Liu
Tao Liu
Tong Liu
W. M. Liu
Xiang Liu
Xiaohui Liu
Xiaoyu Liu
Xin Liu
Xinglin Liu
Xingquan Liu
Yang Liu
Xiao-Hai Liu
Yanlin Liu
Yao-Bei Liu
Yi Liu
Yiming Liu
Yong Liu
Yonglu Liu
Yu Liu
Yubin Liu
Yudong Liu
Yulong Liu
Zhaofeng Liu
Zhenchao Liu
Zhi Liu
Zhi-Feng Liu
Zhiqing Liu
Zhongfu Liu
Zuowei Liu
Mia Liu
Zhen Liu
Xiaoyang Liu
Xinchou Lou
Cai-Dian Lu
Jun-Xu Lu
Qiu Zhen Lu
Shang Lu
Wenxi Lu
Xiaohan Lu
Yunpeng Lu
Zhiyong Lu
Xianguo Lu
Wei Lu
Bayarto Lubsandorzhiev
Sultim Lubsandorzhiev
Arslan Lukanov
Jinliang Luo
Tao Luo
xiaoan Luo
Xiaofeng Luo
Xiaolan Luo
Jindong Lv
Feng Lyu
Xiao-Rui Lyu
Kun-Feng Lyu
Ande Ma
Hong-Hao Ma
Jun-Li Ma
Kai Ma
Lishuang Ma
Na Ma
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Weihu Ma
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Yanling Ma
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Yongsheng Ma
Zhonghui Ma
Zhongjian Ma
Yang Ma
Mousam Maity
Lining Mao
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Aure´lien Martens
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Guozhu Ning
Jia-Shu Niu
Juan-Juan Niu
Yan Niu
Edward Khomotso Nkadimeng
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Stathes Paganis
Collette Pakuza
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Juntong Pan
Tong Pan
Xiang Pan
Papia Panda
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Haoyu Shi
Hua Shi
Qi Shi
Shusu Shi
Xiaolei Shi
Xin Shi
Yukun Shi
Zhan Shi
Ian Shipsey
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Zong-Guo Si
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Aodong Song
Huayang Song
Jiaojiao Song
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Weimin Song
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Shashwat Sourav
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Feng Su
Shengsen Su
Wei Su
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Yanfeng Sui
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Pengfei Sun
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Xiaohu Sun
Xilei Sun
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Xin-Yuan Sun
Yanjun Sun
Yongzhao Sun
Yue Sun
Zheng Sun
Narumon Suwonjandee
Elsayed Tag Eldin
Biao Tan
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Liang Tang
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Junquan Tao
Abdel Nasser Tawfik
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Natasa Vukasinovic
Xia Wan
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En Wang
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Haolin Wang
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Jin Wang
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Wei Wang
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Na Wang
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Qian Wang
Qun Wang
Shu Lin Wang
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Taofeng Wang
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Tianyang Wang
Xiaolong Wang
Xiaoning Wang
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Xiongfei Wang
Xujian Wang
Yaping Wang
Yaqian Wang
Yiao Wang
Yifang Wang
Yilun Wang
Yiwei Wang
You-Kai Wang
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Weiping Wang
Zeren Simon Wang
Biao Wang
Hao Wang
Lian-Tao Wang
Zihui Wang
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Jia Wang
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Da Xu
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Jian Zhai
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Xin Zhe Zhai
Xi-Jie Zhan
Ben-Wei Zhang
Bolun Zhang
Di Zhang
Guangyi Zhang
Hao Zhang
Hong-Hao Zhang
Huaqiao Zhang
Hui Zhang
Jian Wang
Jianzhong Zhang
Jiehao Zhang
Jielei Zhang
Jingru Zhang
Jinxian Zhang
Junsong Zhang
Junxing Zhang
Lei Zhang
Liang Zhang
Licheng Zhang
Liming Zhang
Linhao Zhang
Mengchao Zhang
Shulei Zhang
Wan Zhang
Wenchao Zhang
Xiangzhen Zhang
Xiaomei Zhang
Xiaoming Zhang
Xiaoxu Zhang
Xiaoyu Zhang
Xuantong Zhang
Xueyao Zhang
Yang Zhang
Yanxi Zhang
Yao Zhang
Ying Zhang
Yixiang Zhang
Yizhou Zhang
Yongchao Zhang
Yu Zhang
Yuan Zhang
Yujie Zhang
Yulei Zhang
Yumei Zhang
Yunlong Zhang
Zhandong Zhang
Zhaoru Zhang
Zhen-Hua Zhang
Zhenyu Zhang
Zhichao Zhang
Zhi-Qing Zhang
Zhuo Zhang
Zhiqing Zhang
Cong Zhang
Tianliang Zhang
Luyan Zhang
Guang Zhao
Hongyun Zhao
Jie Zhao
Jingxia Zhao
Jingyi Zhao
Ling Zhao
Luyang Zhao
Mei Zhao
Minggang Zhao
Mingrui Zhao
Ruiguang Zhao
Tongxian Zhao
Yaliang Zhao
Ying Zhao
Yue Zhao
Zhiyu Zhao
Zhuo Zhao
Alexey Zhemchugov
Hongjuan Zheng
Jinchao Zheng
Liang Zheng
Ran Zheng
shanxi zheng
Xu-Chang Zheng
Wang Zhile
Weicai Zhong
Yi-Ming Zhong
Chen Zhou
Daicui Zhou
Jianxin Zhou
Jing Zhou
Ning Zhou
Qi-Dong Zhou
Shiyu Zhou
Shun Zhou
Sihong Zhou
Xiang Zhou
Xingyu Zhou
Yang Zhou
Yong Zhou
Yu-Feng Zhou
Zusheng Zhou
Demin Zhou
Dechong Zhu
Hongbo Zhu
Huaxing Zhu
Jingya Zhu
Kai Zhu
Pengxuan Zhu
Ruilin Zhu
Xianglei Zhu
Yingshun Zhu
Yongfeng Zhu
Xiao Zhuang
Xuai Zhuang
Mikhail Zobov
Zhanguo Zong
Cong Zou
Hongying Zou
Reaction-conditioned De Novo Enzyme Design with GENzyme
Chenqing Hua
Jiarui Lu
Yong Liu
Odin Zhang
Rex Ying
Wengong Jin
Shuangjia Zheng
The introduction of models like RFDiffusionAA, AlphaFold3, AlphaProteo, and Chai1 has revolutionized protein structure modeling and interact… (see more)ion prediction, primarily from a binding perspective, focusing on creating ideal lock-and-key models. However, these methods can fall short for enzyme-substrate interactions, where perfect binding models are rare, and induced fit states are more common. To address this, we shift to a functional perspective for enzyme design, where the enzyme function is defined by the reaction it catalyzes. Here, we introduce \textsc{GENzyme}, a \textit{de novo} enzyme design model that takes a catalytic reaction as input and generates the catalytic pocket, full enzyme structure, and enzyme-substrate binding complex. \textsc{GENzyme} is an end-to-end, three-staged model that integrates (1) a catalytic pocket generation and sequence co-design module, (2) a pocket inpainting and enzyme inverse folding module, and (3) a binding and screening module to optimize and predict enzyme-substrate complexes. The entire design process is driven by the catalytic reaction being targeted. This reaction-first approach allows for more accurate and biologically relevant enzyme design, potentially surpassing structure-based and binding-focused models in creating enzymes capable of catalyzing specific reactions. We provide \textsc{GENzyme} code at https://github.com/WillHua127/GENzyme.
Reaction-conditioned De Novo Enzyme Design with GENzyme
Chenqing Hua
Jiarui Lu
Yong Liu
Odin Zhang
Rex Ying
Wengong Jin
Shuangjia Zheng
The introduction of models like RFDiffusionAA, AlphaFold3, AlphaProteo, and Chai1 has revolutionized protein structure modeling and interact… (see more)ion prediction, primarily from a binding perspective, focusing on creating ideal lock-and-key models. However, these methods can fall short for enzyme-substrate interactions, where perfect binding models are rare, and induced fit states are more common. To address this, we shift to a functional perspective for enzyme design, where the enzyme function is defined by the reaction it catalyzes. Here, we introduce \textsc{GENzyme}, a \textit{de novo} enzyme design model that takes a catalytic reaction as input and generates the catalytic pocket, full enzyme structure, and enzyme-substrate binding complex. \textsc{GENzyme} is an end-to-end, three-staged model that integrates (1) a catalytic pocket generation and sequence co-design module, (2) a pocket inpainting and enzyme inverse folding module, and (3) a binding and screening module to optimize and predict enzyme-substrate complexes. The entire design process is driven by the catalytic reaction being targeted. This reaction-first approach allows for more accurate and biologically relevant enzyme design, potentially surpassing structure-based and binding-focused models in creating enzymes capable of catalyzing specific reactions. We provide \textsc{GENzyme} code at https://github.com/WillHua127/GENzyme.
Reaction-conditioned De Novo Enzyme Design with GENzyme
Chenqing Hua
Jiarui Lu
Yong Liu
Odin Zhang
Rex Ying
Wengong Jin
Shuangjia Zheng
The introduction of models like RFDiffusionAA, AlphaFold3, AlphaProteo, and Chai1 has revolutionized protein structure modeling and interact… (see more)ion prediction, primarily from a binding perspective, focusing on creating ideal lock-and-key models. However, these methods can fall short for enzyme-substrate interactions, where perfect binding models are rare, and induced fit states are more common. To address this, we shift to a functional perspective for enzyme design, where the enzyme function is defined by the reaction it catalyzes. Here, we introduce \textsc{GENzyme}, a \textit{de novo} enzyme design model that takes a catalytic reaction as input and generates the catalytic pocket, full enzyme structure, and enzyme-substrate binding complex. \textsc{GENzyme} is an end-to-end, three-staged model that integrates (1) a catalytic pocket generation and sequence co-design module, (2) a pocket inpainting and enzyme inverse folding module, and (3) a binding and screening module to optimize and predict enzyme-substrate complexes. The entire design process is driven by the catalytic reaction being targeted. This reaction-first approach allows for more accurate and biologically relevant enzyme design, potentially surpassing structure-based and binding-focused models in creating enzymes capable of catalyzing specific reactions. We provide \textsc{GENzyme} code at https://github.com/WillHua127/GENzyme.