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Mateusz K Bieniek

Showing results (1-10 of 6) with videos related to

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Journal of Chemical Theory and Computation|January 25, 2021
TIES 20: Relative Binding Free Energy with a Flexible Superimposition Algorithm and Partial Ring MorphingMateusz K Bieniek, Agastya P Bhati, Shunzhou Wan, et al.
Digital Discovery|January 16, 2025
Active learning driven prioritisation of compounds from on-demand libraries targeting the SARS-CoV-2 main proteaseBen Cree, Mateusz K Bieniek, Siddique Amin, et al.
Journal of Chemical Theory and Computation|May 29, 2023
Long Time Scale Ensemble Methods in Molecular Dynamics: Ligand-Protein Interactions and Allostery in SARS-CoV-2 TargetsAgastya P Bhati, Art Hoti, Andrew Potterton, et al.
Journal of Chemical Information and Modeling|January 31, 2023
TIES 2.0: A Dual-Topology Open Source Relative Binding Free Energy Builder with Web PortalMateusz K Bieniek, Alexander D Wade, Agastya P Bhati, et al.
Communications Chemistry|November 2, 2022
An open-source molecular builder and free energy preparation workflowMateusz K Bieniek, Ben Cree, Rachael Pirie, et al.
Journal of Chemical Information and Modeling|June 20, 2025
CACHE Challenge #2: Targeting the RNA Site of the SARS-CoV-2 Helicase Nsp13Oleksandra Herasymenko, Madhushika Silva, Abd Al-Aziz A Abu-Saleh, et al.
Pageof 1

Showing results (1-10 of 6) with videos related to

Sort By:
Pageof 1
Journal of Chemical Theory and Computation|January 25, 2021
TIES 20: Relative Binding Free Energy with a Flexible Superimposition Algorithm and Partial Ring MorphingMateusz K Bieniek, Agastya P Bhati, Shunzhou Wan, et al.
Digital Discovery|January 16, 2025
Active learning driven prioritisation of compounds from on-demand libraries targeting the SARS-CoV-2 main proteaseBen Cree, Mateusz K Bieniek, Siddique Amin, et al.
Journal of Chemical Theory and Computation|May 29, 2023
Long Time Scale Ensemble Methods in Molecular Dynamics: Ligand-Protein Interactions and Allostery in SARS-CoV-2 TargetsAgastya P Bhati, Art Hoti, Andrew Potterton, et al.
Journal of Chemical Information and Modeling|January 31, 2023
TIES 2.0: A Dual-Topology Open Source Relative Binding Free Energy Builder with Web PortalMateusz K Bieniek, Alexander D Wade, Agastya P Bhati, et al.
Communications Chemistry|November 2, 2022
An open-source molecular builder and free energy preparation workflowMateusz K Bieniek, Ben Cree, Rachael Pirie, et al.
Journal of Chemical Information and Modeling|June 20, 2025
CACHE Challenge #2: Targeting the RNA Site of the SARS-CoV-2 Helicase Nsp13Oleksandra Herasymenko, Madhushika Silva, Abd Al-Aziz A Abu-Saleh, et al.
Pageof 1