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...focuses primarily on biomedical research involving protein dynamics, drug discovery, and computational biology.<ref name="gpugrid_about">{{cite web |url=https: ...first=Stefan |title=HTMD: High-Throughput Molecular Dynamics for Molecular Discovery |journal=Journal of Chemical Theory and Computation |volume=12 |issue=4 |pa ...

| category = Biochemistry / Drug Discovery ...INC'''''] to perform high-throughput [[wikipedia:Virtual screening|virtual drug screening]] against dangerous viral pathogens. Launched in December 2020 as ...

...'', which used a distributed computing grid to screen 35 million potential drug molecules against several smallpox proteins. In the first 72 hours alone, 1 ...s WCG's biomedical projects is '''molecular docking''', in which candidate drug molecules are algorithmically fitted to target protein structures to predic ...

| category = Bioinformatics, Genetics, Drug discovery ...g System for Discovering Causal Relationships Among Human Genes to Improve Drug Repositioning |journal=IEEE Transactions on Emerging Topics in Computing |y ...

...olding]], protein structure prediction, computational protein design, drug discovery, vaccine development, and molecular modeling.<ref>{{cite web * Drug discovery ...

...ute]], a widely used open-source program for molecular docking and virtual drug screening.<ref name=about/> It now also accepts any science application pac [[File:Cd20.png|thumb|AutoDock Vina is used for molecular docking and virtual drug screening.]] ...

| Independent decentralized drug design by volunteer computing. [[SiDock@home|See more...]] ...de humanitarian problems. Subprojects include(d) GO Fight Against Malaria, Drug Search for Leishmaniasis, Computing for Clean Water, Clean Energy Project, ...