Research output per year
Research output per year
Collaborations and top research areas from the last five years
Recent external collaboration on country/territory level. Dive into details by clicking on the dots or
Research output
- 10 Article
-
Accurate machine learning force fields via experimental and simulation data fusion
Röcken, S. & Zavadlav, J., Dec 2024, In: npj Computational Materials. 10, 1, 69.Research output: Contribution to journal › Article › peer-review
Open Access2 Scopus citations -
Active learning graph neural networks for partial charge prediction of metal-organic frameworks via dropout Monte Carlo
Thaler, S., Mayr, F., Thomas, S., Gagliardi, A. & Zavadlav, J., Dec 2024, In: npj Computational Materials. 10, 1, 86.Research output: Contribution to journal › Article › peer-review
Open Access1 Scopus citations -
Developing an Implicit Solvation Machine Learning Model for Molecular Simulations of Ionic Media
Coste, A., Slejko, E., Zavadlav, J. & Praprotnik, M., 9 Jan 2024, In: Journal of Chemical Theory and Computation. 20, 1, p. 411-420 10 p.Research output: Contribution to journal › Article › peer-review
Open Access1 Scopus citations