Christian F A Negre

5PUBLICATIONS
12CO-AUTHORS
Formal methods for softwareTheoretical quantum chemistryStatistical mechanics, physical combinatorics and mathematical aspects of condensed matterNumerical solution of differential and integral equationsProteomics and intermolecular interactions (excl. medical proteomics)
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Publications (5)

|Mar 29, 2024
Hybrid programming-model strategies for GPU offloading of electronic structure calculation kernels.

Jean-Luc Fattebert, Christian F A Negre, Joshua Finkelstein

|Feb 22, 2023
Graph-based quantum response theory and shadow Born-Oppenheimer molecular dynamics.

Christian F A Negre, Michael E Wall, Anders M N Niklasson

|Jun 06, 2022
Toward a QUBO-Based Density Matrix Electronic Structure Method.

Christian F A Negre, Alejandro Lopez-Bezanilla, Yu Zhang

|May 09, 2022
Controlled precision QUBO-based algorithm to compute eigenvectors of symmetric matrices.

Benjamin Krakoff, Susan M Mniszewski, Christian F A Negre

|Dec 12, 2018
Eigenvector centrality for characterization of protein allosteric pathways.

Christian F A Negre, Uriel N Morzan, Heidi P Hendrickson

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Frequent Collaborators

3 joint publications

Susan M Mniszewski

2 joint publications

Yu Zhang

2 joint publications

Michael E Wall

1 joint publications

Victor S Batista