An Ghysels

According to our database, An Ghysels authored at least 5 papers between 2010 and 2024.

Collaborative distances:

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

2024

PyRETIS 3: Conquering rare and slow events without boundaries.

Wouter Vervust, Daniel T. Zhang, An Ghysels, Sander Roet, Titus S. van Erp, Enrico Riccardi

J. Comput. Chem., June, 2024

2023

Capric Acid and Myristic Acid Permeability Enhancers in Curved Liposome Membranes.

Samaneh Davoudi, Koen Raemdonck, Kevin Braeckmans, An Ghysels

J. Chem. Inf. Model., November, 2023

2012

Comparing normal modes across different models and scales: Hessian reduction <i>versus</i> coarse-graining.

An Ghysels, Benjamin T. Miller, Frank C. Pickard IV, Bernard R. Brooks

J. Comput. Chem., 2012

2010

TAMkin: A Versatile Package for Vibrational Analysis and Chemical Kinetics.

An Ghysels, Toon Verstraelen, Karen Hemelsoet, Michel Waroquier, Veronique Van Speybroeck

J. Chem. Inf. Model., 2010

Comparative study of various normal mode analysis techniques based on partial Hessians.

An Ghysels, Veronique Van Speybroeck, Ewald Pauwels, Saron Catak, Bernard R. Brooks, Dimitri Van Neck, Michel Waroquier

J. Comput. Chem., 2010