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Disambiguation of "Liedl, Klaus R."

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Determination of spectroscopic constants from rovibrational configuration interaction calculations

, , , , and . The journal of chemical physics, 157 (15): 154107 (2022)
DOI: 10.1063/5.0116018

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To differ between persons with the same name, the academic degree and the title of an important publication will be displayed. You can also use the button next to the name to display some publications already assigned to the person.

R. Koerner

R. Watty

Janos Klaus University of Stuttgart

Klaus Hentschel

apl. Prof. Dr. -Ing. Klaus Leonhardt University of Stuttgart

 

Other publications of authors with the same name

A QM-MM interface between CHARMM and TURBOMOLE: Implementation and application to systems in bulk phase and biologically active systems., , and . Journal of Computational Chemistry, 24 (10): 1240-1249 (2003)Protease Inhibitors in View of Peptide Substrate Databases., , , , and . Journal of Chemical Information and Modeling, 56 (6): 1228-1235 (2016)Strong Nonadditivity as a Key Structure-Activity Relationship Feature: Distinguishing Structural Changes from Assay Artifacts., , and . Journal of Chemical Information and Modeling, 55 (3): 483-494 (2015)Entropy in specificity and thermodynamics of binding.. J. Cheminformatics, 6 (S-1): 8 (2014)Limits to molecular matched-pair analysis: the experimental uncertainty case., and . J. Cheminformatics, 6 (S-1): 6 (2014)Heteroaromatic π-Stacking Energy Landscapes., , , , , , and . Journal of Chemical Information and Modeling, 54 (5): 1371-1379 (2014)Application of multivariate data analysis methods to Comparative Molecular Field Analysis (CoMFA) data: Proton affinities and pKa prediction for nucleic acids components., , , and . Journal of Computer-Aided Molecular Design, 13 (6): 611-623 (1999)Qualitative prediction of blood-brain barrier permeability on a large and refined dataset., , , and . Journal of Computer-Aided Molecular Design, 25 (12): 1095-1106 (2011)A challenging system: Free energy prediction for factor Xa., , and . Journal of Computational Chemistry, 32 (8): 1743-1752 (2011)Comparative docking studies on ligand binding to the multispecific antibodies IgE-La2 and IgE-Lb4., , , , and . Journal of Computer-Aided Molecular Design, 10 (4): 305-320 (1996)