Webinar: BioExcel HPC Workflows: predictive power and its applications in pharmacology (2022-04-26)

By |April 7, 2022|Categories: Webinars|

Three different workflows designed as a collaborative project effort from the CoE partners (NBD, IRB, BSC, KTH, MPG) are briefly presented.

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Webinar: Gromacs/pmx for large scale alchemical protein-ligand binding affinity screening (2022-04-21)

By |April 7, 2022|Categories: Webinars|

Vytas Gapsys talks about the latest developments in PMX focusing on the protein-ligand binding affinity calculations.

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Webinar: Improvements in the GROMACS heterogeneous parallelization (2022-04-05)

By |March 8, 2022|Categories: Webinars|

Szilard talks about the advances and improvements which enable the performance, flexibility and portability of GROMACS.

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Webinar: X3DNA-DSSR, a resource for structural bioinformatics of nucleic acids (2021-12-09)

By |November 16, 2021|Categories: Webinars|

Dr Xiang-Jun Lu, at Columbia University, will give an overview of the main features of Dissecting the Spatial Structure of RNA (DSSR).

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