White paper: ultra-large GOLD docking on cloud resources
Structure-based docking screens of large compound libraries are vital in early-phase drug discovery. Advancements in cloud computing and the availability of large, high-quality datasets now make it possible to perform virtual screening studies at an ultra-high-throughput scale while incurring only modest costs.
We recently tested the robustness of our docking package, GOLD, on cloud-based resources with a docking run of about 130 million compounds. We successfully docked about 3.85 million molecules per hour.
Download the white paper to learn about our costs and methods, as well as:
How GOLD docking performed at an ultra-large scale on standard, cloud-computing environments.
How our recommended methods ensure secure job communication.
What scripts, support, and other user documentation we provide to help ensure your success.
WHITE PAPER DOWNLOAD
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