|
Eine Ebene nach oben |
Gruppiert nach: Dokumententyp |
Veröffentlichungsdatum
Anzahl der Publikationen: 4
2022
Dass, Avinash Vicholous; Wunnava, Sreekar; Langlais, Juliette; Esch, Beatriz von der; Krusche, Maik; Ufer, Lennard; Chrisam, Nico; Dubini, Romeo C. A.; Gartner, Florian; Angerpointner, Severin; Dirscherl, Christina F.; Rovo, Petra; Mast, Christof B.; Sponer, Judit E.; Ochsenfeld, Christian; Frey, Erwin und Braun, Dieter
(2022):
RNA Oligomerisation without Added Catalyst from 2 ',3 '-Cyclic Nucleotides by Drying at Air-Water Interfaces.
In: Chemsystemschem
[PDF, 860kB]
Stan, Alexandra; Esch, Beatriz von der und Ochsenfeld, Christian
(2022):
Fully Automated Generation of Prebiotically Relevant Reaction Networks from Optimized Nanoreactor Simulations.
In: Journal of Chemical Theory and Computation, Bd. 18, Nr. 11: S. 6700-6712
2021
Esch, Beatriz von der; Peters, Laurens D. M.; Sauerland, Lena und Ochsenfeld, Christian
(2021):
Quantitative Comparison of Experimental and Computed IR-Spectra Extracted from Ab Initio Molecular Dynamics.
In: Journal of Chemical Theory and Computation, Bd. 17, Nr. 2: S. 985-995
2019
Esch, Beatriz von der; Dietschreit, Johannes C. B.; Peters, Laurens D. M. und Ochsenfeld, Christian
(2019):
Finding Reactive Configurations: A Machine Learning Approach for Estimating Energy Barriers Applied to Sirtuin 5.
In: Journal of Chemical Theory and Computation, Bd. 15, Nr. 12: S. 6660-6667