17 citations · 20 across the 2 of their papers we have counts for
2 papers
physics.chem-ph2022★ 17 cited
Accurate Machine Learned Quantum-Mechanical Force Fields for Biomolecular Simulations
Oliver T. Unke, Martin Stöhr, Stefan Ganscha +8
Molecular dynamics (MD) simulations allow atomistic insights into chemical and biological processes. Accurate MD simulations require computationally demanding quantum-mechanical ca…
q-bio.QM2016★ 3 cited
matLeap: A fast adaptive Matlab-ready tau-leaping implementation suitable for Bayesian inference
Justin Feigelman, Stefan Ganscha, Manfred Claassen
Background: Species abundance distributions in chemical reaction network models cannot usually be computed analytically. Instead, stochas- tic simulation algorithms allow sample fr…