Per-Ola Norrby

Publication Activity (10 Years)

Years Active: 1995-2023
Publications (10 Years): 1

Top Topics

Partial Occlusion

Predictive Model

Top Venues

J. Comput. Chem.

J. Chem. Inf. Model.

Publications

Samuel Genheden, Per-Ola Norrby, Ola Engkvist
AiZynthTrain: Robust, Reproducible, and Extensible Pipelines for Training Synthesis Prediction Models. J. Chem. Inf. Model. 63 (7) (2023)
Elaine Limé, Per-Ola Norrby
Improving the Q2MM method for transition state force field modeling. J. Comput. Chem. 36 (4) (2015)
Anne Techau Jørgensen, Per-Ola Norrby, Tommy Liljefors
Investigation of the metal binding site in methionine aminopeptidase by density functional theory. J. Comput. Aided Mol. Des. 16 (3) (2002)
Per-Ola Norrby, Tommy Liljefors
Automated molecular mechanics parameterization with simultaneous utilization of experimental and quantum mechanical data. J. Comput. Chem. 19 (10) (1998)
Jonas Boström, Per-Ola Norrby, Tommy Liljefors
Conformational energy penalties of protein-bound ligands. J. Comput. Aided Mol. Des. 12 (4) (1998)
Klaus Gundertofte, Tommy Liljefors, Per-Ola Norrby, Ingrid Pettersson
A comparison of conformational energies calculated by several molecular mechanics methods. J. Comput. Chem. 17 (4) (1996)
Per-Ola Norrby, Kenneth Wärnmark, Björn Âkermark, Christina Moberg
Unusual Conformational-Determining Interactions in Oxymethylpyridines: An Ab Initio Study and an Improved Method for Refining Molecular Mechanics Parameters. J. Comput. Chem. 16 (5) (1995)