Corso et al. |
DiffDock-L: Diffusion Steps, Twists, and Turns for Molecular Docking
- Run
- About
- Past jobs
DiffDock-L (v.1.1.3) is the latest and improved version of DiffDock, a cutting-edge method for predicting molecular docking and drug binding structures. DiffDock-L offers a major enhancement in both performance and generalization capabilities, making it a more advanced and reliable tool for drug discovery and related applications.
Example use case: Predict binding structure of a ligand to a protein for the sake of drug discovery
Technology: Diffusion
Limitation:
- Some of the parameters were kept default. Please see this page for more details.
Metrics:
- Please visit the paper for the model metrics.
Citation:
Corso, G., Stark, H., Jing, B., Barzilay, R., & Jaakkola, T. (n.d.). DiffDock: Diffusion steps, twists, and turns for molecular docking. https://doi.org/10.48550/arXiv.2210.01776
Released:
Dec-21-2022
Dec-21-2022
Previous Job Parameters
Your previous job parameters will show up here
so you can keep track of your jobs
so you can keep track of your jobs