Christoph Wehmeyer

Citeras av

	Alla	Sedan 2020
Citat	2870	2123
h-index	16	9
i10-index	18	9

480

240

120

360

2012201320142015201620172018201920202021202220232024202514 27 23 26 60 100 222 254 375 358 398 454 461 77

Offentlig åtkomst

Visa alla

13 artiklar

4 artiklar

tillgänglig

inte tillgänglig

Enligt krav från finansiärer

Medförfattare

Noe FrankMicrosoft ResearchVerifierad e-postadress på microsoft.com
Daniel SebastianiProfessor of Theoretical Chemistry, University Halle, GermanyVerifierad e-postadress på chemie.uni-halle.de
Jan-Hendrik PrinzMemorial Sloan Kettering Cancer CenterVerifierad e-postadress på choderalab.org
Hao WuFree university of BerlinVerifierad e-postadress på zedat.fu-berlin.de
Cecilia ClementiProfessor of Physics, Freie Universität BerlinVerifierad e-postadress på fu-berlin.de
Simon OlssonChalmers University of TechnologyVerifierad e-postadress på chalmers.se
Guillermo Pérez-HernándezCharité Universitätsmedizin BerlinVerifierad e-postadress på charite.de
Moritz HoffmannFreie Universität BerlinVerifierad e-postadress på fu-berlin.de
Gianni De FabritiisComputational Science Laboratory, Icrea Research Professor, AcelleraVerifierad e-postadress på upf.edu
Adrià PérezPhD Student, UPFVerifierad e-postadress på upf.edu
Nicholas E. CharronZuse Institute BerlinVerifierad e-postadress på zib.de
Johannes SchönebergUC San Diego School of MedicineVerifierad e-postadress på schoeneberglab.org
Esam T. AbualrousFreie Universität BerlinVerifierad e-postadress på fu-berlin.de
Michael CrabtreeUniversity of OxfordVerifierad e-postadress på bioch.ox.ac.uk
Thomas WeiklGroup leader in the Department of Biomolecular Systems, Max Planck Institute of Colloids andVerifierad e-postadress på mpikg.mpg.de
Feliks NüskeMax Planck Institute for Dynamics of Complex Technical Systems, MagdeburgVerifierad e-postadress på mpi-magdeburg.mpg.de
Ernesto SuárezProfesor de Lógica ComputacionalVerifierad e-postadress på ucab.edu.ve
Rafal P. WiewioraPrincipal, Molecular Design & Computational Biophysics, Psivant TherapeuticsVerifierad e-postadress på psivant.com
Daniel M. ZuckermanProfessor of Biomedical Engineering. Oregon Health & Science UniversityVerifierad e-postadress på ohsu.edu
John D. ChoderaMemorial Sloan-Kettering Cancer CenterVerifierad e-postadress på mskcc.org

Följ

Christoph Wehmeyer

Statice, Anonos

Verifierad e-postadress på statice.ai

machine learning scientific computing


Titel Sortera efter citat Sortera efter år Sortera efter titel	Citeras av Citeras av	År
PyEMMA 2: A software package for estimation, validation, and analysis of Markov models MK Scherer, B Trendelkamp-Schroer, F Paul, G Pérez-Hernández, ... Journal of chemical theory and computation 11 (11), 5525-5542, 2015	1113	2015
Machine learning of coarse-grained molecular dynamics force fields J Wang, S Olsson, C Wehmeyer, A Pérez, NE Charron, G De Fabritiis, ... ACS central science 5 (5), 755-767, 2019	497	2019
Time-lagged autoencoders: Deep learning of slow collective variables for molecular kinetics C Wehmeyer, F Noé The Journal of chemical physics 148 (24), 2018	433	2018
Multiensemble Markov models of molecular thermodynamics and kinetics H Wu, F Paul, C Wehmeyer, F Noé Proceedings of the National Academy of Sciences 113 (23), E3221-E3230, 2016	225	2016
Protein-peptide association kinetics beyond the seconds timescale from atomistic simulations F Paul, C Wehmeyer, ET Abualrous, H Wu, MD Crabtree, J Schöneberg, ... Nature communications 8 (1), 1095, 2017	156	2017
Markov state models from short non-equilibrium simulations—Analysis and correction of estimation bias F Nüske, H Wu, JH Prinz, C Wehmeyer, C Clementi, F Noé The Journal of Chemical Physics 146 (9), 2017	88	2017
What Markov state models can and cannot do: Correlation versus path-based observables in protein-folding models E Suárez, RP Wiewiora, C Wehmeyer, F Noé, JD Chodera, ... Journal of chemical theory and computation 17 (5), 3119-3133, 2021	61	2021
A unified framework for quantifying privacy risk in synthetic data M Giomi, F Boenisch, C Wehmeyer, B Tasnádi arXiv preprint arXiv:2211.10459, 2022	55	2022
MHC class II complexes sample intermediate states along the peptide exchange pathway M Wieczorek, J Sticht, S Stolzenberg, S Günther, C Wehmeyer, Z El Habre, ... Nature Communications 7 (1), 13224, 2016	48	2016
Artificial bee colony optimization of capping potentials for hybrid quantum mechanical/molecular mechanical calculations C Schiffmann, D Sebastiani Journal of Chemical Theory and Computation 7 (5), 1307-1315, 2011	31	2011
Shock dynamics of two-lane driven lattice gases C Schiffmann, C Appert-Rolland, L Santen Journal of Statistical Mechanics: Theory and Experiment 2010 (06), P06002, 2010	29	2010
The structure and IR signatures of the arginine-glutamate salt bridge. Insights from the classical MD simulations MV Vener, AV Odinokov, C Wehmeyer, D Sebastiani The Journal of chemical physics 142 (21), 2015	23	2015
A coupled molecular dynamics/kinetic Monte Carlo approach for protonation dynamics in extended systems G Kabbe, C Wehmeyer, D Sebastiani Journal of Chemical Theory and Computation 10 (10), 4221-4228, 2014	23	2014
Specific quantum mechanical/molecular mechanical capping-potentials for biomolecular functional groups AC Ihrig, C Schiffmann, D Sebastiani The Journal of chemical physics 135 (21), 2011	23	2011
Water-Free Proton Conduction in Hexakis(p-Phosphonatophenyl)benzene Nanochannels C Wehmeyer, M Schrader, D Andrienko, D Sebastiani The Journal of Physical Chemistry C 117 (23), 12366-12372, 2013	18	2013
Hydrogen bond networks: Structure and dynamics via first‐principles spectroscopy C Schiffmann, D Sebastiani physica status solidi (b) 249 (2), 368-375, 2012	17	2012
Foraging on the potential energy surface: A swarm intelligence-based optimizer for molecular geometry C Wehmeyer, G Falk von Rudorff, S Wolf, G Kabbe, D Schärf, TD Kühne, ... The Journal of Chemical Physics 137 (19), 2012	16	2012
Isotopic superlattices for perfect phonon reflection G Bastian, A Vogelsang, C Schiffmann Journal of electronic materials 39, 1769-1771, 2010	11	2010
Efficient implementation and application of the artificial bee colony algorithm to low-dimensional optimization problems GF von Rudorff, C Wehmeyer, D Sebastiani Computer Physics Communications 185 (6), 1639-1646, 2014	2	2014
Introduction to Markov state modeling with the PyEMMA software—v1. 0 C Wehmeyer, MK Scherer, T Hempel, BE Husic, S Olsson, F Noé Living J. Comput. Mol. Sci 1 (10.33011), 2018	1	2018

Systemet kan inte utföra åtgärden just nu. Försök igen senare.

Artiklar 1–20

Citat per år

Dubblettcitat

Sammanfogade citat

Lägg till medförfattareMedförfattare

Följ

Citeras av

Medförfattare