Concepedia

Maximilian Kubillus

MK

Statistics

Publications

6

Citations

550

H-Index

6

Active since

2014

Affiliations

Karlsruhe Institute of Technology(Current)

University of Wisconsin–Madison

Maximilian Kubillus is an author at Karlsruhe Institute of Technology specializing in chemistry, natural sciences, and quantum chemistry.

ORCID

Publications per year

2014–2019

6

Publications

6

Parameterization of the DFTB3 Method for Br, Ca, Cl, F, I, K, and Na in Organic and Biological Systems

Maximilian Kubillus, Tomáš Kubař, Michael Gaus et al. · Journal of Chemical Theory and Computation · 2014 · 317 citations

, , +13

Parametrization and Benchmark of Long-Range Corrected DFTB2 for Organic Molecules

Van‐Quan Vuong, Maximilian Kubillus, Julian Kranz et al. · Journal of Chemical Theory and Computation · 2017 · 95 citations · Full text

, , +15

Generalized Density-Functional Tight-Binding Repulsive Potentials from Unsupervised Machine Learning

Julian Kranz, Maximilian Kubillus, Raghunathan Ramakrishnan et al. · Journal of Chemical Theory and Computation · 2018 · 64 citations

, , +16

Quantum Effects in Cation Interactions with First and Second Coordination Shell Ligands in Metalloproteins

Van A. Ngo, Maurício Chagas da Silva, Maximilian Kubillus et al. · Journal of Chemical Theory and Computation · 2015 · 49 citations · Full text

, , +17

Cation solvation with quantum chemical effects modeled by a size-consistent multi-partitioning quantum mechanics/molecular mechanics method

Hiroshi Watanabe, Maximilian Kubillus, Tomáš Kubař et al. · Physical Chemistry Chemical Physics · 2017 · 15 citations

, , +17

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