Robert K. Szilagyi

According to our database, Robert K. Szilagyi authored at least 6 papers between 2006 and 2023.

Collaborative distances:

• Dijkstra number of seven.
• Erdős number of seven.

2023

Development of molecular cluster models to probe pyrite surface reactivity.

Manjinder Kour, Attila Táborosi, Eric S. Boyd, Robert K. Szilagyi

J. Comput. Chem., 2023

2019

Secondary structure analysis of peptides with relevance to iron-sulfur cluster nesting.

Rebecca Hanscam, Eric M. Shepard, Joan B. Broderick, Valérie Copié, Robert K. Szilagyi

J. Comput. Chem., 2019

2016

Protein environmental effects on iron-sulfur clusters: A set of rules for constructing computational models for inner and outer coordination spheres.

Travis V. Harris, Robert K. Szilagyi

J. Comput. Chem., 2016

2014

Iron-sulfur bond covalency from electronic structure calculations for classical iron-sulfur clusters.

Travis V. Harris, Robert K. Szilagyi

J. Comput. Chem., 2014

2011

<i>In silico</i> evaluation of proposed biosynthetic pathways for the unique dithiolate ligand of the H-cluster of [FeFe]-hydrogenase.

Alexios Grigoropoulos, Robert K. Szilagyi

J. Comput. Chem., 2011

2006

On the accuracy of density functional theory for iron - sulfur clusters.

Robert K. Szilagyi, Mark A. Winslow

J. Comput. Chem., 2006