The SPICE dataset is a collection of over 1.1 million molecular structures used to train machine learning models for simulating […]
We have recently added a new application to PlayMolecule: AceProfiler. This tool allows you to easily navigate the Protein Data […]
During 14-16 July 2022, Acellera and Universitat Pompeu Fabra are co-organizing the MMSML Workshop, a three-day get together of discussions, […]
We just stumbled upon this nice article from Alicja Gawalska et al. [1], where they report a suitable binding site […]
CrypticScout is one of the most popular applications of PlayMolecule, Acellera’s drug discovery platform. This mixed solvent MD application allows […]
This new collaboration between C4X Discovery (“C4XD”) and Acellera aims to elucidate the binding mode of a library of new […]
Today we announce the start of the formal collaboration between Acellera and Chemotargets. Both companies have a long history of […]
In this new tutorial, we will show you how to use different PlayMolecule apps to explore the chemical space nearby […]
KDeep is one of the most used apps on PlayMolecule, Acellera’s drug discovery platform. The application enables users to predict […]
We have just released the new version of ACEMD, Acellera’s molecular dynamics software specifically designed for fast execution on NVIDIA […]