logo
CanyamAI summaries for academic research
language
MobileMobile
  • Phone FeatureWeChat Mini Program
EnglishEnglish
noticeNotice
BlogBlog
delete
arrow
Back
F

Frank Noé

microsoft research

70H-index
405Paper Count
2.4WCitation Count
Published Papers 148
Publication Date
logo
An ab initio foundation model of wavefunctions that accurately describes chemical bond breaking
errNature Communications
IF15.7
err2026-08-21
err0
errOAAI
errAdam Foster; Zeno Schätzle; P. Bernát Szabó; Lixue Cheng; Jonas Köhler; Gino Cassella; Nicholas Gao; Jiawei Li; Frank Noé; Jan Hermann
errShare
errSave
Scalable Boltzmann generators for equilibrium sampling of large-scale materials
errNature Communications
IF15.7
err2026-06-05
err0
errOAAI
errMaximilian Schebek; Frank Noé; Jutta Rogal
errShare
errSave
Extending the range of graph neural networks with global encodings
errNature Communications
IF15.7
err2026-02-18
err0
errOAAI
errAlessandro Caruso; Jacopo Venturin; Lorenzo Giambagli; Edoardo Rolando; Zakariya El-Machachi; Frank Noé; Cecilia Clementi
errShare
errSave
Secondary structure transitions and dual PIP2 binding define cardiac KCNQ1-KCNE1 channel gating
errCell Research
IF25.9
err2025-10-02
err0
errOAAI
errLing Zhong; Xiaoqing Lin; Xinyu Cheng; Shuangyan Wan; Yaoguang Hua; Weiwei Nan; Bin Hu; Xiangjun Peng; Zihan Zhou; Qiansen Zhang; Huaiyu Yang; Frank Noé; Zhenzhen Yan; Dexiang Jiang; Hangyu Zhang; Fengjiao Liu; Chenxin Xiao; Zhuo Zhou; Yimin Mou; Haijie Yu; Lijuan Ma; Chen Huang; Vincent Kam Wai Wong; Sookja Kim Chung; Bing Shen; Zhi-Hong Jiang; Erwin Neher; Wandi Zhu; Jin Zhang; Panpan Hou
errShare
errSave
Conformational changes, excess area, and elasticity of the Piezo protein-membrane nanodome from coarse-grained and atomistic simulations
errELIFE
IF0
err2025-09-24
err0
PREAI
errDixit, Sneha; Noe, Frank; Weikl, Thomas R.
errShare
errSave
Simulations and active learning enable efficient identification of an experimentally-validated broad coronavirus inhibitor
errNature Communications
IF15.7
err2025-07-29
err0
errOAAI
errKatarina Elez; Tim Hempel; Jonathan H. Shrimp; Nicole Moor; Lluís Raich; Cheila Rocha; Robin Winter; Tuan Le; Stefan Pöhlmann; Markus Hoffmann; Matthew D. Hall; Frank Noé
errShare
errSave
Navigating protein landscapes with a machine-learned transferable coarse-grained model
errNature Chemistry
IF20.2
err2025-07-18
err0
errOAAI
errNicholas E. Charron; Klara Bonneau; Aldo S. Pasos-Trejo; Andrea Guljas; Yaoyi Chen; Félix Musil; Jacopo Venturin; Daria Gusew; Iryna Zaporozhets; Andreas Krämer; Clark Templeton; Atharva Kelkar; Aleksander E. P. Durumeric; Simon Olsson; Adrià Pérez; Maciej Majewski; Brooke E. Husic; Ankit Patel; Gianni De Fabritiis; Frank Noé; Cecilia Clementi
errShare
errSave
Scalable emulation of protein equilibrium ensembles with generative deep learning
errScience
IF45.8
err2025-07-10
err0
PREAI
errSarah Lewis; Tim Hempel; José Jiménez-Luna; Michael Gastegger; Yu Xie; Andrew Y. K. Foong; Victor García Satorras; Osama Abdin; Bastiaan S. Veeling; Iryna Zaporozhets; Yaoyi Chen; Soojung Yang; Adam E. Foster; Arne Schneuing; Jigyasa Nigam; Federico Barbero; Vincent Stimper; Andrew Campbell; Jason Yim; Marten Lienen; Yu Shi; Shuxin Zheng; Hannes Schulz; Usman Munir; Roberto Sordillo; Ryota Tomioka; Cecilia Clementi; Frank Noé
errShare
errSave
Artificially intelligent Maxwell's demon for optimal control of open quantum systems
errQUANTUM SCIENCE AND TECHNOLOGY
IF5
err2025-03-27
err0
errOAAI
errErdman, Paolo A.; Czupryniak, Robert; Bhandari, Bibek; Jordan, Andrew N.; Noe, Frank; Guarnieri, Giacomo
errShare
errSave
Highly accurate real-space electron densities with neural networks
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2025-01-21
err0
PREAI
errCheng, Lixue; Szabo, P. Bernat; Schaetzle, Zeno; Kooi, Derk P.; Koehler, Jonas; Giesbertz, Klaas J. H.; Noe, Frank; Hermann, Jan; Gori-Giorgi, Paola; Foster, Adam
errShare
errSave
Efficient mapping of phase diagrams with conditional Boltzmann Generators
errMACHINE LEARNING-SCIENCE AND TECHNOLOGY
IF4.6
err2024-11-22
err1
errOAAI
errSchebek, Maximilian; Invernizzi, Michele; Noe, Frank; Rogal, Jutta
errShare
errSave
Dicke superradiant heat current enhancement in circuit quantum electrodynamics
errPHYSICAL REVIEW RESEARCH
IF4.2
err2024-11-12
err0
PREAI
errAndolina, Gian Marcello; Erdman, Paolo Andrea; Noe, Frank; Pekola, Jukka; Schiro, Marco
errShare
errSave
Predicting equilibrium distributions for molecular systems with deep learning (vol 6, pg 558, 2024)
errNATURE MACHINE INTELLIGENCE
IF23.9
err2024-10-29
err0
errOAAI
errZheng, Shuxin; He, Jiyan; Liu, Chang; Shi, Yu; Lu, Ziheng; Feng, Weitao; Ju, Fusong; Wang, Jiaxi; Zhu, Jianwei; Min, Yaosen; Zhang, He; Tang, Shidi; Hao, Hongxia; Jin, Peiran; Chen, Chi; Noe, Frank; Liu, Haiguang; Liu, Tie-Yan
errShare
errSave
An Improved Penalty-Based Excited-State Variational Monte Carlo Approach with Deep-Learning Ansatzes
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2024-08-30
err3
errOAAI
errSzabo, P. Bernat; Schaetzle, Zeno; Entwistle, Michael T.; Noe, Frank
errShare
errSave
Structure prediction of alternative protein conformations
errNATURE COMMUNICATIONS
IF15.7
err2024-08-26
err1
errOAAI
errBryant, Patrick; Noe, Frank
errShare
errSave
Structure prediction of protein-ligand complexes from sequence information with Umol
errNATURE COMMUNICATIONS
IF15.7
err2024-05-28
err9
errOAAI
errBryant, Patrick; Kelkar, Atharva; Guljas, Andrea; Clementi, Cecilia; Noe, Frank
errShare
errSave
Predicting equilibrium distributions for molecular systems with deep learning
errNATURE MACHINE INTELLIGENCE
IF23.9
err2024-05-08
err10
errOAAI
errZheng, Shuxin; He, Jiyan; Liu, Chang; Shi, Yu; Lu, Ziheng; Feng, Weitao; Ju, Fusong; Wang, Jiaxi; Zhu, Jianwei; Min, Yaosen; Zhang, He; Tang, Shidi; Hao, Hongxia; Jin, Peiran; Chen, Chi; Noe, Frank; Liu, Haiguang; Liu, Tie-Yan
errShare
errSave
Optimal thermometers with spin networks
errQUANTUM SCIENCE AND TECHNOLOGY
IF5
err2024-04-12
err3
errOAAI
errAbiuso, Paolo; Erdman, Paolo Andrea; Ronen, Michael; Noe, Frank; Haack, Geraldine; Perarnau-Llobet, Marti
errShare
errSave
Reaction coordinate flows for model reduction of molecular kinetics
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2024-01-25
err6
errOAAI
errWu, Hao; Noe, Frank
errShare
errSave
Sub-membrane actin rings compartmentalize the plasma membrane
errJOURNAL OF CELL BIOLOGY
IF6.4
err2024-01-22
err3
errOAAI
errRentsch, Jakob; Bandstra, Selle; Sezen, Batuhan; Sigrist, Philipp; Bottanelli, Francesca; Schmerl, Bettina; Shoichet, Sarah; Noe, Frank; Sadeghi, Mohsen; Ewers, Helge
errShare
errSave

Research Directions

No research directions
Co-authors
Cooperation Journals
M
Marc E. Rothenberg
H-index: 137 · Papers: 1.4K
E
Erwin Neher
H-index: 129 · Papers: 376
B
Berend Smit
H-index: 121 · Papers: 794
V
Vijay S. Pande
H-index: 110 · Papers: 494
J
Jeremy C. Smith
H-index: 107 · Papers: 1.3K
View more