Chung F Wong

6PUBLICATIONS
0CO-AUTHORS
Computational chemistryBiomolecular modelling and designSemi- and unsupervised learningCheminformatics and quantitative structure-activity relationships
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Publications (6)

|Apr 19, 2024
Quantitative Prediction of Dissociation Rates of PYK2 Ligands Using Umbrella Sampling and Milestoning.

Justin Spiriti, Chung F Wong

|Sep 15, 2022
Milestoning simulation of ligand dissociation from the glycogen synthase kinase 3β.

Samith Rathnayake, Brajesh Narayan, Ron Elber

|Sep 08, 2022
Simulation of ligand dissociation kinetics from the protein kinase PYK2.

Justin Spiriti, Frank Noé, Chung F Wong

|Mar 18, 2021
EDock-ML: A web server for using ensemble docking with machine learning to aid drug discovery.

Tanay Chandak, Chung F Wong

|May 14, 2020
Using machine learning to improve ensemble docking for drug discovery.

Tanay Chandak, John P Mayginnes, Howard Mayes

|Mar 03, 2018
Steered molecular dynamics simulations for uncovering the molecular mechanisms of drug dissociation and for drug screening: A test on the focal adhesion kinase.

Chung F Wong

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