Webinar: Gromacs/pmx for large scale alchemical protein-ligand binding affinity screening (2022-04-21)
Vytas Gapsys talks about the latest developments in PMX focusing on the protein-ligand binding affinity calculations.
Webinar: Improvements in the GROMACS heterogeneous parallelization (2022-04-05)
Szilard talks about the advances and improvements which enable the performance, flexibility and portability of GROMACS.
Webinar: What’s new in GROMACS 2022 (2022-03-08)
Paul will give an overview of the new features included in the new release of GROMACS 2022.
Webinar: Social Media in Science Communication (2022-02-17)
Michelle talks on the increasing demand for researchers to build a digital presence and the role of social media in science communication.
Webinar: X3DNA-DSSR, a resource for structural bioinformatics of nucleic acids (2021-12-09)
Dr Xiang-Jun Lu, at Columbia University, will give an overview of the main features of Dissecting the Spatial Structure of RNA (DSSR).
Webinar: CHARMM Force Field Development History, Features, and Implementation in GROMACS (2021-11-23)
Justin Lemkul will present the functional form and parametrization strategy of the CHARMM force field, along with key features that can be exploited for simulations of complex systems.
