Casper Steinmann

PeerJ Author

Summary

Biochemistry Bioinformatics Computational Biology Computational Science

Past or current institution affiliations

Aalborg University

University of Southern Denmark

Lund University

University of Bristol

Work details

Associate Professor

Aalborg University

September 2017

Department of Chemistry and Bioscience

Postdoc

Lund University

January 2017

Postdoc

University of Southern Denmark

March 2013 - October 2015

Department of Physics, Chemistry and Pharmacy

Postdoc

University of Bristol

November 2015 - December 2016

Centre for Computational Chemistry

Identities

@caspersteinmann

Websites

PeerJ Contributions

May 17, 2021

Using a genetic algorithm to find molecules with good docking scores

Casper Steinmann, Jan H. Jensen

https://doi.org/10.7717/peerj-pchem.18

June 19, 2014

A third-generation dispersion and third-generation hydrogen bonding corrected PM6 method: PM6-D3H+

Jimmy C. Kromann, Anders S. Christensen, Casper Steinmann, Martin Korth, Jan H. Jensen

https://doi.org/10.7717/peerj.449 PubMed 25024918

July 23, 2013

A computational method for the systematic screening of reaction barriers in enzymes: searching for Bacillus circulans xylanase mutants with greater activity towards a synthetic substrate

Martin R. Hediger, Casper Steinmann, Luca De Vico, Jan H. Jensen

https://doi.org/10.7717/peerj.111 PubMed 23904990

April 4, 2014 - Version: 1

A third-generation dispersion and third-generation hydrogen bonding corrected PM6 method: PM6-D3H+

Jimmy Charnley Kromann, Anders Christensen, Casper Steinmann, Martin Korth, Jan H. Jensen

https://doi.org/10.7287/peerj.preprints.353v1

1 Question

Dielectric constant used for PCM calculations

about ProCS15: A DFT-based chemical shift predictor for backbone and Cβ atoms in proteins

1 Answer

accepted Dielectric constant used for PCM calculations