svatunek // lab

Preprints

1. 4.

   T. Demuth, J. Schnizer, D. Svatunek*
   strainedSMILES2xyz: A Workflow for Reliable 3D Structures of Strained Molecules from SMILES
   

   ChemRxiv, 2025, DOI: 10.26434/chemrxiv-2025-30dqz

   
2. 3.

   T. Demuth, D. Svatunek*
   Energy Decomposition Analysis of Theozymes: Insights and Limitations
   

   ChemRxiv, 2025, DOI: 10.26434/chemrxiv-2025-nd9z9

   
3. 2.

   W. Kuba*, A. Schiefer, A. Löffler, N. Houszka, S. Schnöll, M. Staudt, T. Demuth, B. Sohr, M. Haider, R. Kohler, R. Weissleder, D. Svatunek, J. Carlson*, H. Mikula*
   Next-Level Bioorthogonal Bond-Cleavage Through Intramolecular Control of Click-To-Release Chemistry
   

   ChemRxiv, 2025, DOI: 10.26434/chemrxiv-2025-7s39f

   
4. 1.

   D. Svatunek*
   Computational Large-Scale Screening of Bioorthogonal 1,2,4,5-Tetrazine/trans-Cyclooctene Cycloadditions
   

   ChemRxiv, 2024, Preprint, DOI: 10.26434/chemrxiv-2024-24xcv