
Frank Noé
Refine list

refinements active!
zoomed in on ?? of ?? records
view refined list in
export refined list as
2020 – today
- 2021
- [i18]Robin Winter, Frank Noé, Djork-Arné Clevert:
Auto-Encoding Molecular Conformations. CoRR abs/2101.01618 (2021) - [i17]Tuan Le, Marco Bertolini, Frank Noé, Djork-Arné Clevert:
Parameterized Hypercomplex Graph Neural Networks for Graph Classification. CoRR abs/2103.16584 (2021) - 2020
- [j14]Robin Winter
, Joren Retel, Frank Noé, Djork-Arné Clevert, Andreas Steffen:
grünifai: interactive multiparameter optimization of molecules in a continuous vector space. Bioinform. 36(13): 4093-4094 (2020) - [j13]Hao Wu
, Frank Noé:
Variational Approach for Learning Markov Processes from Time Series Data. J. Nonlinear Sci. 30(1): 23-66 (2020) - [c11]Jonas Köhler, Leon Klein, Frank Noé:
Equivariant Flows: Exact Likelihood Generative Learning for Symmetric Densities. ICML 2020: 5361-5370 - [c10]Andreas Mardt, Luca Pasquali, Frank Noé, Hao Wu:
Deep learning Markov and Koopman models with physical constraints. MSML 2020: 451-475 - [c9]Hao Wu, Jonas Köhler, Frank Noé:
Stochastic Normalizing Flows. NeurIPS 2020 - [i16]Hao Wu, Jonas Köhler
, Frank Noé:
Stochastic Normalizing Flows. CoRR abs/2002.06707 (2020) - [i15]Jonas Köhler, Leon Klein, Frank Noé:
Equivariant Flows: exact likelihood generative learning for symmetric densities. CoRR abs/2006.02425 (2020) - [i14]Benjamin Kurt Miller
, Mario Geiger, Tess E. Smidt, Frank Noé:
Relevance of Rotationally Equivariant Convolutions for Predicting Molecular Properties. CoRR abs/2008.08461 (2020) - [i13]Zeno Schätzle, Jan Hermann, Frank Noé:
Convergence to the fixed-node limit in deep variational Monte Carlo. CoRR abs/2010.05316 (2020) - [i12]Andreas Krämer, Jonas Köhler, Frank Noé:
Training Neural Networks with Property-Preserving Parameter Perturbations. CoRR abs/2010.07033 (2020) - [i11]Stefan Doerr, Maciej Majewski, Adrià Pérez, Andreas Krämer, Cecilia Clementi, Frank Noé, Toni Giorgino, Gianni De Fabritiis:
TorchMD: A deep learning framework for molecular simulations. CoRR abs/2012.12106 (2020)
2010 – 2019
- 2019
- [j12]Moritz Hoffmann
, Christoph Fröhner
, Frank Noé
:
ReaDDy 2: Fast and flexible software framework for interacting-particle reaction dynamics. PLoS Comput. Biol. 15(2) (2019) - [c8]John R. Ossyra, Ada Sedova
, Arnold N. Tharrington
, Frank Noé
, Cecilia Clementi
, Jeremy C. Smith
:
Porting Adaptive Ensemble Molecular Dynamics Workflows to the Summit Supercomputer. ISC Workshops 2019: 397-417 - [i10]Jan Hermann, Zeno Schätzle, Frank Noé:
Deep neural network solution of the electronic Schrödinger equation. CoRR abs/1909.08423 (2019) - [i9]Jonas Köhler, Leon Klein, Frank Noé:
Equivariant Flows: sampling configurations for multi-body systems with symmetric energies. CoRR abs/1910.00753 (2019) - [i8]Moritz Hoffmann, Frank Noé:
Generating valid Euclidean distance matrices. CoRR abs/1910.03131 (2019) - [i7]Frank Noé, Alexandre Tkatchenko, Klaus-Robert Müller, Cecilia Clementi:
Machine learning for molecular simulation. CoRR abs/1911.02792 (2019) - 2018
- [j11]Péter Koltai
, Hao Wu, Frank Noé
, Christof Schütte:
Optimal Data-Driven Estimation of Generalized Markov State Models for Non-Equilibrium Dynamics. Comput. 6(1): 22 (2018) - [j10]Stefan Klus
, Feliks Nüske
, Péter Koltai, Hao Wu, Ioannis G. Kevrekidis, Christof Schütte, Frank Noé:
Data-Driven Model Reduction and Transfer Operator Approximation. J. Nonlinear Sci. 28(3): 985-1010 (2018) - [c7]Hao Wu, Andreas Mardt, Luca Pasquali, Frank Noé:
Deep Generative Markov State Models. NeurIPS 2018: 3979-3988 - [i6]Hao Wu, Andreas Mardt, Luca Pasquali, Frank Noé:
Deep Generative Markov State Models. CoRR abs/1805.07601 (2018) - [i5]Frank Noé, Hao Wu:
Boltzmann Generators - Sampling Equilibrium States of Many-Body Systems with Deep Learning. CoRR abs/1812.01729 (2018) - [i4]Jiang Wang, Christoph Wehmeyer, Frank Noé, Cecilia Clementi:
Machine Learning of coarse-grained Molecular Dynamics Force Fields. CoRR abs/1812.01736 (2018) - [i3]Frank Noé:
Machine Learning for Molecular Dynamics on Long Timescales. CoRR abs/1812.07669 (2018) - 2017
- [i2]Christoph Wehmeyer, Frank Noé:
Time-lagged autoencoders: Deep learning of slow collective variables for molecular kinetics. CoRR abs/1710.11239 (2017) - 2016
- [c6]Hao Wu, Frank Noé:
Spectral Learning of Dynamic Systems from Nonequilibrium Data. NIPS 2016: 4179-4187 - [i1]Hao Wu, Frank Noé:
Spectral learning of dynamic systems from nonequilibrium data. CoRR abs/1609.00932 (2016) - 2015
- [j9]Alexander Ullrich, Mathias A. Böhme
, Johannes Schöneberg
, Harald Depner, Stephan J. Sigrist, Frank Noé:
Dynamical Organization of Syntaxin-1A at the Presynaptic Active Zone. PLoS Comput. Biol. 11(9) (2015) - 2014
- [j8]Hao Wu, Frank Noé:
Optimal Estimation of Free Energies and Stationary Densities from Multiple Biased Simulations. Multiscale Model. Simul. 12(1): 25-54 (2014) - 2013
- [j7]Frank Noé, Feliks Nüske
:
A Variational Approach to Modeling Slow Processes in Stochastic Dynamical Systems. Multiscale Model. Simul. 11(2): 635-655 (2013) - [j6]York Posor, Marielle Eichhorn-Gruenig, Dmytro Puchkov
, Johannes Schöneberg
, Alexander Ullrich, André Lampe
, Rainer Müller, Sirus Zarbakhsh, Federico Gulluni
, Emilio Hirsch
, Michael Krauss
, Carsten Schultz
, Jan Schmoranzer
, Frank Noé, Volker Haucke
:
Spatiotemporal control of endocytosis by phosphatidylinositol-3, 4-bisphosphate. Nat. 499(7457): 233-237 (2013) - 2011
- [j5]Jan-Hendrik Prinz, Martin Held, Jeremy C. Smith
, Frank Noé:
Efficient Computation, Sensitivity, and Error Analysis of Committor Probabilities for Complex Dynamical Processes. Multiscale Model. Simul. 9(2): 545-567 (2011) - [c5]Hao Wu, Frank Noé:
A flat Dirichlet process switching model for Bayesian estimation of hybrid systems. ICCS 2011: 1393-1402 - 2010
- [j4]Marco Sarich, Frank Noé, Christof Schütte:
On the Approximation Quality of Markov State Models. Multiscale Model. Simul. 8(4): 1154-1177 (2010) - [j3]Hao Wu, Frank Noé:
Probability Distance Based Compression of Hidden Markov Models. Multiscale Model. Simul. 8(5): 1838-1861 (2010) - [c4]Hao Wu, Frank Noé:
Maximum a posteriori estimation for Markov chains based on Gaussian Markov random fields. ICCS 2010: 1665-1673
2000 – 2009
- 2007
- [j2]Lin Wang, Minghu Jiang, Yinghua Lu, Minfu Sun, Frank Noé:
A Comparative Study of Clustering Methods for Molecular Data. Int. J. Neural Syst. 17(6): 447-458 (2007) - [c3]Frank Noé, Marcus Oswald, Gerhard Reinelt:
Optimizing in Graphs with Expensive Computation of Edge Weights. OR 2007: 435-440 - 2006
- [j1]Frank Noé, Marcus Oswald, Gerhard Reinelt, Stefan Fischer, Jeremy C. Smith
:
Computing Best Transition Pathways in High-Dimensional Dynamical Systems: Application to the AlphaL \leftrightharpoons Beta \leftrightharpoons AlphaR Transitions in Octaalanine. Multiscale Model. Simul. 5(2): 393-419 (2006) - [c2]Lin Wang, Minghu Jiang, Yinghua Lu, Frank Noé, Jeremy C. Smith:
Clustering Analysis of Competitive Learning Network for Molecular Data. ISNN (1) 2006: 1244-1249 - [c1]Lin Wang, Minghu Jiang, Yinghua Lu, Frank Noé, Jeremy C. Smith:
Self-Organizing Map Clustering Analysis for Molecular Data. ISNN (1) 2006: 1250-1255
Coauthor Index

manage site settings
To protect your privacy, all features that rely on external API calls from your browser are turned off by default. You need to opt-in for them to become active. All settings here will be stored as cookies with your web browser. For more information see our F.A.Q.
Unpaywalled article links
Add open access links from to the list of external document links (if available).
Privacy notice: By enabling the option above, your browser will contact the API of unpaywall.org to load hyperlinks to open access articles. Although we do not have any reason to believe that your call will be tracked, we do not have any control over how the remote server uses your data. So please proceed with care and consider checking the Unpaywall privacy policy.
Archived links via Wayback Machine
For web page which are no longer available, try to retrieve content from the of the Internet Archive (if available).
load content from web.archive.org
Privacy notice: By enabling the option above, your browser will contact the API of web.archive.org to check for archived content of web pages that are no longer available. Although we do not have any reason to believe that your call will be tracked, we do not have any control over how the remote server uses your data. So please proceed with care and consider checking the Internet Archive privacy policy.
Reference lists
Add a list of references from ,
, and
to record detail pages.
load references from crossref.org and opencitations.net
Privacy notice: By enabling the option above, your browser will contact the APIs of crossref.org, opencitations.net, and semanticscholar.org to load article reference information. Although we do not have any reason to believe that your call will be tracked, we do not have any control over how the remote server uses your data. So please proceed with care and consider checking the Crossref privacy policy and the OpenCitations privacy policy, as well as the AI2 Privacy Policy covering Semantic Scholar.
Citation data
Add a list of citing articles from and
to record detail pages.
load citations from opencitations.net
Privacy notice: By enabling the option above, your browser will contact the API of opencitations.net and semanticscholar.org to load citation information. Although we do not have any reason to believe that your call will be tracked, we do not have any control over how the remote server uses your data. So please proceed with care and consider checking the OpenCitations privacy policy as well as the AI2 Privacy Policy covering Semantic Scholar.
Tweets on dblp homepage
Show tweets from on the dblp homepage.
Privacy notice: By enabling the option above, your browser will contact twitter.com and twimg.com to load tweets curated by our Twitter account. At the same time, Twitter will persistently store several cookies with your web browser. While we did signal Twitter to not track our users by setting the "dnt" flag, we do not have any control over how Twitter uses your data. So please proceed with care and consider checking the Twitter privacy policy.
last updated on 2021-04-09 00:09 CEST by the dblp team
all metadata released as open data under CC0 1.0 license
see also: Terms of Use | Privacy Policy | Imprint