Henry van den Bedem

20PUBLICATIONS
46CO-AUTHORS
Biomolecular modelling and designCheminformatics and quantitative structure-activity relationshipsBioinorganic chemistryStructure and dynamics of materialsChemical thermodynamics and energetics
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Publications (20)

|Jun 30, 2025
Expanding automated multiconformer ligand modeling to macrocycles and fragments.

Jessica Flowers, Nathaniel Echols, Galen J Correy

|Oct 29, 2024
NGT: Generative AI with Synthesizability Guarantees Discovers MC2R Inhibitors from a Tera-Scale Virtual Screen.

Saulo H P de Oliveira, Aryan Pedawi, Victor Kenyon

|May 29, 2024
Microbes 'sieve' ions on their surface to start the nitrogen cycle.

Henry van den Bedem

|Jul 10, 2023
Uncovering Protein Ensembles: Automated Multiconformer Model Building for X-ray Crystallography and Cryo-EM.

Stephanie A Wankowicz, Ashraya Ravikumar, Shivani Sharma

|May 20, 2022
Kinematic Vibrational Entropy Assessment and Analysis of SARS CoV-2 Main Protease.

Xiyu Chen, Sigrid Leyendecker, Henry van den Bedem

|Mar 02, 2022
AtomNet PoseRanker: Enriching Ligand Pose Quality for Dynamic Proteins in Virtual High-Throughput Screens.

Kate A Stafford, Brandon M Anderson, Jon Sorenson

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Frequent Collaborators

5 joint publications

James S Fraser

3 joint publications

Daniel A Keedy

3 joint publications

Stephanie A Wankowicz

2 joint publications

Jessica Flowers