Per-Ola Norrby

According to our database, Per-Ola Norrby authored at least 7 papers between 1995 and 2023.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of five.

2023

AiZynthTrain: Robust, Reproducible, and Extensible Pipelines for Training Synthesis Prediction Models.

Samuel Genheden, Per-Ola Norrby, Ola Engkvist

J. Chem. Inf. Model., April, 2023

2015

Improving the Q2MM method for transition state force field modeling.

Elaine Limé, Per-Ola Norrby

J. Comput. Chem., 2015

2002

Investigation of the metal binding site in methionine aminopeptidase by density functional theory.

Anne Techau Jørgensen, Per-Ola Norrby, Tommy Liljefors

J. Comput. Aided Mol. Des., 2002

1998

Automated molecular mechanics parameterization with simultaneous utilization of experimental and quantum mechanical data.

Per-Ola Norrby, Tommy Liljefors

J. Comput. Chem., 1998

Conformational energy penalties of protein-bound ligands.

Jonas Boström, Per-Ola Norrby, Tommy Liljefors

J. Comput. Aided Mol. Des., 1998

1996

A comparison of conformational energies calculated by several molecular mechanics methods.

Klaus Gundertofte, Tommy Liljefors, Per-Ola Norrby, Ingrid Pettersson

J. Comput. Chem., 1996

1995

Unusual Conformational-Determining Interactions in Oxymethylpyridines: An Ab Initio Study and an Improved Method for Refining Molecular Mechanics Parameters.

Per-Ola Norrby, Kenneth Wärnmark, Björn Âkermark, Christina Moberg

J. Comput. Chem., 1995