Tomáš Trnka

3PUBLICATIONS
29CO-AUTHORS
Automated software engineeringComputational chemistry
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Publications (3)

|Apr 22, 2025
The Amsterdam Modeling Suite.

Evert Jan Baerends, Nestor F Aguirre, Nick D Austin

|Oct 29, 2019
ReaxFF Parameter Optimization with Monte-Carlo and Evolutionary Algorithms: Guidelines and Insights.

Ganna Shchygol, Alexei Yakovlev, Tomáš Trnka

|Nov 21, 2017
Automated Training of ReaxFF Reactive Force Fields for Energetics of Enzymatic Reactions.

Tomáš Trnka, Igor Tvaroška, Jaroslav Koča

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