SDSC provides high-performance computing and data infrastructure that support researchers doing molecular modeling and ...
The developers of OpenFold3 have released an early version of the tool, which they hope will one day perform on par with DeepMind’s protein-structure model.
With a newly developed method that compares AI-generated protein sequences with naturally occurring ones, function- and ...
Virtual screening methods fall broadly into two categories: ligand- and structure-based. Ligand-based virtual screening doesn’t require a target protein structure, Instead, it leverages known active ...
A quick, purification-free method was developed by researchers at the Institute of Science Tokyo, to capture the detailed 3D ...
Researchers used cryo-EM to study how the HIV enzyme integrase arranges in 3D to slip its DNA into the host genome and pack ...
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Integrating physicochemical laws into future AI models for better drug design
Proteins play a key role not only in the body, but also in medicine: they either serve as active ingredients, such as enzymes ...
The rate of HIV infection continues to climb globally. Around 40 million people live with HIV-1, the most common HIV strain.
An international research team has determined the first high-resolution structures of the herpes simplex virus origin-binding ...
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