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Robert K. Szilagyi

Name: dblp XML data dump
Creator: Schloss Dagstuhl - Leibniz Center for Informatics
Published: 1993
License: https://creativecommons.org/publicdomain/zero/1.0/
Keywords: dblp, XML, computer science, scholarly publications, metadata

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2023
[j6]
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  - journals/jcc/KourTBS23
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  - https://dblp.org/rec/journals/jcc/KourTBS23
Manjinder Kour, Attila Táborosi, Eric S. Boyd, Robert K. Szilagyi:
Development of molecular cluster models to probe pyrite surface reactivity. J. Comput. Chem. 44(32): 2486-2500 (2023)
2019
[j5]
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  - journals/jcc/HanscamSBCS19
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Rebecca Hanscam, Eric M. Shepard, Joan B. Broderick, Valérie Copié, Robert K. Szilagyi:
Secondary structure analysis of peptides with relevance to iron-sulfur cluster nesting. J. Comput. Chem. 40(2): 515-526 (2019)
2016
[j4]
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  - journals/jcc/HarrisS16
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Travis V. Harris, Robert K. Szilagyi:
Protein environmental effects on iron-sulfur clusters: A set of rules for constructing computational models for inner and outer coordination spheres. J. Comput. Chem. 37(18): 1681-1696 (2016)
2014
[j3]
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Travis V. Harris, Robert K. Szilagyi:
Iron-sulfur bond covalency from electronic structure calculations for classical iron-sulfur clusters. J. Comput. Chem. 35(7): 540-552 (2014)
2011
[j2]
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  - journals/jcc/GrigoropoulosS11
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Alexios Grigoropoulos, Robert K. Szilagyi:
In silico evaluation of proposed biosynthetic pathways for the unique dithiolate ligand of the H-cluster of [FeFe]-hydrogenase. J. Comput. Chem. 32(15): 3194-3206 (2011)
2006
[j1]
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Robert K. Szilagyi, Mark A. Winslow:
On the accuracy of density functional theory for iron - sulfur clusters. J. Comput. Chem. 27(12): 1385-1397 (2006)

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Schloss Dagstuhl - Leibniz Center for Informatics is a member of the Leibniz Association and is funded by the federal government of Germany and the states of Germany, especially Saarland and Rhineland‑Palatinate.