Sara Tkaczyk

2PUBLICATIONS
3CO-AUTHORS
Theoretical quantum chemistry
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Publications (2)

|Dec 17, 2025
Repeatability of Relative Free Energy Calculations in Solution with ANI-2x and MACE-OFF23.

Sara Tkaczyk, Thierry Langer, Marcus Wieder

|Nov 11, 2025
Architecture-Independent Absolute Solvation Free Energy Calculations with Neural Network Potentials.

Anna Katharina Picha, Sara Tkaczyk, Thierry Langer

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Frequent Collaborators

2 joint publications

Thierry Langer

2 joint publications

Stefan Boresch

1 joint publications

Andrea Rizzi