Patrick K. Quoika

According to our database, Patrick K. Quoika authored at least 6 papers between 2020 and 2026.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of five.

2026

ParallelKDE.jl: A Package for Highly Parallel Kernel Density Estimation.

Christian Sustay Martinez, Martin Zacharias, Patrick K. Quoika

J. Open Source Softw., March, 2026

2024

Structure-Based Protein Assembly Simulations Including Various Binding Sites and Conformations.

Luis J. Walter, Patrick K. Quoika, Martin Zacharias

J. Chem. Inf. Model., 2024

2023

Structural mechanism of Fab domain dissociation as a measure of interface stability.

Nancy D. Pomarici, Franz Waibl, Patrick K. Quoika, Alexander Bujotzek, Guy Georges, Monica L. Fernández-Quintero, Klaus R. Liedl

J. Comput. Aided Mol. Des., 2023

2021

pyPolyBuilder: Automated Preparation of Molecular Topologies and Initial Configurations for Molecular Dynamics Simulations of Arbitrary Supramolecules.

Mayk C. Ramos, Patrick K. Quoika, Vitor A. C. Horta, Douglas Mota Dias, Elan G. Costa, Jorge Luís Machado do Amaral, Luigi M. Ribeiro, Klaus R. Liedl, Bruno A. C. Horta

J. Chem. Inf. Model., 2021

X-Entropy: A Parallelized Kernel Density Estimator with Automated Bandwidth Selection to Calculate Entropy.

Johannes Kraml, Florian Hofer, Patrick K. Quoika, Anna S. Kamenik, Klaus R. Liedl

J. Chem. Inf. Model., 2021

2020

Macrocycle Cell Permeability Measured by Solvation Free Energies in Polar and Apolar Environments.

Anna S. Kamenik, Johannes Kraml, Florian Hofer, Franz Waibl, Patrick K. Quoika, Ursula Kahler, Michael Schauperl, Klaus R. Liedl

J. Chem. Inf. Model., 2020