Marc van der Kamp

According to our database, Marc van der Kamp authored at least 7 papers between 2017 and 2024.

Collaborative distances:

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

2024

Influence of Wobbling Tryptophan and Mutations on PET Degradation Explored by QM/MM Free Energy Calculations.

Anna Jäckering, Marc van der Kamp, Birgit Strodel, Kirill Zinovjev

J. Chem. Inf. Model., 2024

2022

Reliable In Silico Ranking of Engineered Therapeutic TCR Binding Affinities with MMPB/GBSA.

Rory M. Crean, Christopher R. Pudney, David K. Cole, Marc van der Kamp

J. Chem. Inf. Model., 2022

2020

Multi-scale simulation reveals that an amino acid substitution increases photosensitizing reaction inputs in Rhodopsins.

Erix Wiliam Hernández-Rodríguez, Andrés M. Escorcia, Marc van der Kamp, Ana Lilian Montero-Alejo, Julio Caballero

J. Comput. Chem., 2020

Enlighten2: molecular dynamics simulations of protein-ligand systems made accessible.

Kirill Zinovjev, Marc van der Kamp

Bioinform., 2020

2019

An Efficient Computational Assay for β-Lactam Antibiotic Breakdown by Class A β-Lactamases.

Viivi H. A. Hirvonen, Katharine Hammond, Ewa I. Chudyk, Michael A. L. Limb, James Spencer, Adrian J. Mulholland, Marc van der Kamp

J. Chem. Inf. Model., 2019

Visualizing protein-ligand binding with chemical energy-wise decomposition (CHEWD): application to ligand binding in the kallikrein-8 S1 Site.

Saad Raza, Kara E. Ranaghan, Marc van der Kamp, Christopher J. Woods, Adrian J. Mulholland, Syed Sikander Azam

J. Comput. Aided Mol. Des., 2019

2017

Identification of the quinolinedione inhibitor binding site in Cdc25 phosphatase B through docking and molecular dynamics simulations.

Yushu Ge, Marc van der Kamp, Maturos Malaisree, Dan Liu, Yi Liu, Adrian J. Mulholland

J. Comput. Aided Mol. Des., 2017