Jonah Z. Vilseck

According to our database, Jonah Z. Vilseck authored at least 5 papers between 2011 and 2024.

Collaborative distances:

• Dijkstra number of four.
• Erdős number of four.

2024

A λ-Dynamics Investigation of Insulin <i>Wakayama</i> and Other A3 Variant Binding Affinities to the Insulin Receptor.

Monica P. Barron, Jonah Z. Vilseck

J. Chem. Inf. Model., 2024

2022

Optimizing Multisite λ-Dynamics Throughput with Charge Renormalization.

Jonah Z. Vilseck, Luis F. Cervantes, Ryan L. Hayes, Charles L. Brooks III

J. Chem. Inf. Model., 2022

2018

CDOCKER and λ-dynamics for prospective prediction in D3R Grand Challenge 2.

Xinqiang Ding, Ryan L. Hayes, Jonah Z. Vilseck, Murchtricia K. Charles, Charles L. Brooks III

J. Comput. Aided Mol. Des., 2018

2015

Application of a BOSS - Gaussian interface for QM/MM simulations of Henry and methyl transfer reactions.

Jonah Z. Vilseck, Jakub Kostal, Julian Tirado-Rives, William L. Jorgensen

J. Comput. Chem., 2015

2011

Optimal scaling factors for CM1 and CM3 atomic charges in RM1-based aqueous simulations.

Jonah Z. Vilseck, Somisetti V. Sambasivarao, Orlando Acevedo

J. Comput. Chem., 2011