%0 Generic %1 hansen2024replication %A Hansen, Niels %A Markthaler, Daniel %D 2024 %K %R 10.18419/darus-4135 %T Replication Data for: Biocatalytic stereocontrolled head-to-tail cyclizations of unbiased terpenes as a tool in chemoenzymatic synthesis %X This data set contains all relevant simulation input files (topologies, coordinates, simulation parameters), generated simulation output (final configurations, time series of collective variables) together with scripts used for set-up and analysis of the umbrella sampling and double decoupling simulations.

@misc{hansen2024replication, abstract = {This data set contains all relevant simulation input files (topologies, coordinates, simulation parameters), generated simulation output (final configurations, time series of collective variables) together with scripts used for set-up and analysis of the umbrella sampling and double decoupling simulations. }, added-at = {2024-06-17T10:00:59.000+0200}, affiliation = {Hansen, Niels/Universität Stuttgart, Markthaler, Daniel/Universität Stuttgart}, author = {Hansen, Niels and Markthaler, Daniel}, biburl = {https://puma.ub.uni-stuttgart.de/bibtex/269b0f67af47510a54748f4e0e68153ac/unibiblio}, doi = {10.18419/darus-4135}, howpublished = {Dataset}, interhash = {eb3fb6c8d08b7c6a9109c33d0d996b1d}, intrahash = {69b0f67af47510a54748f4e0e68153ac}, keywords = {}, note = {Related to: Schneider, Andreas; Lystbæk, Thomas B.; Markthaler, Daniel; Hansen, Niels; Hauer, Bernhard (2024): Biocatalytic stereocontrolled head-to-tail cyclizations of unbiased terpenes as a tool in chemoenzymatic synthesis. In: Nature Communications, 15, 4925. doi: 10.1038/s41467-024-48993-9}, orcid-numbers = {Hansen, Niels/0000-0003-4366-6120, Markthaler, Daniel/0000-0003-3281-436X}, timestamp = {2024-06-17T08:00:59.000+0200}, title = {Replication Data for: Biocatalytic stereocontrolled head-to-tail cyclizations of unbiased terpenes as a tool in chemoenzymatic synthesis}, year = 2024 }