Dr. Felix A. Roth
Working area(s)
student assistant 01/13 - 07/14, Bachelor thesis 08/14 - 10/14, Master thesis 09/16 - 03/17, PhD thesis 04/17 - 07/21
Contact
Field of research
- Computer assisted NMR methods
- Software development
Bachelor thesis
| Title | Testing of a portable NMR spectrometer for the organic chemistry teaching lab |
| Group | Prof. Dr. C. M. Thiele |
| Place | Department of Chemistry, Technische Universität Darmstadt |
Master thesis
| Title | SVD-based Analysis of Residual Dipolar Couplings in Symmetrical Molecules |
| Group | Dr. Volker Schmidts, Prof. Dr. C. M. Thiele |
| Place | Department of Chemistry, Technische Universität Darmstadt |
Dissertation
| Title | Structure elucidation of small organic molecules by model-free analysis of residual dipolar couplings |
| Group | Prof. Dr. C. M. Thiele |
| Place | Department of Chemistry, Technical University Darmstadt |
Prizes and awards
| 06/19 | GRC Student Stipend |
Publications
| 1 |
I. Timári, L. Kaltschnee, M. H. Raics, F. Roth, N. G. A. Bell, R. W. Adams, M. Nilsson, D. Uhrín, G. A. Morris, C. M. Thiele, K. E. Kövér Real-time broadband proton-homodecoupled CLIP/CLAP-HSQC for automated measurement of heteronuclear one-bond coupling constants RSC Adv. 2016, 6, 87848-87855. |
| 2 |
F. A. Roth, V. Schmidts, C. M. Thiele TITANIA: Model-Free Interpretation of Residual Dipolar Couplings in the Context of Organic Compounds J. Org. Chem. 2021, 86, 15387-15402. [Source Code: DOI 10.5281/zenodo.5548105, Raw Data: DOI 10.5281/zenodo.5556977, Pre-Print: DOI 10.26434/chemrxiv.14636070.v1] |
| 3 |
F. A. Roth, V. Schmidts, J. Rettig, C. M. Thiele Model Free Analysis of Experimental Residual Dipolar Couplings in Small Organic Compounds Phys. Chem. Chem. Phys. 2022, 24, 281-286. [Raw Data: 10.5281/zenodo.5636052, Pre-Print: 10.26434/chemrxiv.14636316.v1] |
Poster
| 1 |
M. Köberle, A. Hofstädter, F. Roth, V. Schmidts, C. M. Thiele Homopolyaspartates as new alignment medium in NMR spectroscopy of small organic molecules 18. JCF Frühjahrssymposium, Kiel, 03/16. |
| 2 |
F. A. Roth, V. Schmidts, C. M. Thiele SVD based analysis of residual dipolar couplings in symmetrical molecules GDCh FGMR 39th Annual Discussion Meeting, Bayreuth, 09/17. |
| 3 |
F. A. Roth, V. Schmidts, C. M. Thiele Travel to MARS: Constructing the space around your stereogenic centers 691. WE-Heraeus-Seminar on “Physical Organic Chemistry: Recent developments in instrumentation, structure, theory, and mechanisms", Bad Honnef, 02/19. |
| 4 |
F. A. Roth, V. Schmidts, C. M. Thiele TITANIA: Constructing the space around your stereogenic centers Gordon Research Conference “Computational Aspects of Biomolecular NMR”, Les Diablerets/Schweiz, 06/19. |
