Gerard MartínezinPlayMoleculeUsing PlayMolecule® BindScope to participate in the SAMPL7 challenge [TUTORIAL]In this short tutorial we will look at how to use BindScope and, as an example, we will try to generate a submission for the first stafe…Dec 3, 2019Dec 3, 2019
Gerard MartínezinPlayMoleculeSearching for binding pockets using PlayMolecule® DeepSite [TUTORIAL]In this tutorial we will take a look at DeepSite, a web application to search for binding pockets using a 3D neural network-based predictorNov 5, 20193Nov 5, 20193
Gerard MartínezinPlayMoleculeBuilding and running a molecular dynamics (MD) simulation of a protein-ligand system on the…In this article we will look at how to prepare, parameterize, build and run a molecular dynamics (MD) simulation of a protein-ligand…Nov 4, 2019Nov 4, 2019
Gerard MartínezinPlayMoleculeHow to prepare a protein structure using PlayMolecule® ProteinPrepare [TUTORIAL]In this short article we will look at how to use the ProteinPrepare application available at PlayMolecule, a platform for machine learning…Oct 30, 2019Oct 30, 2019
Gerard MartínezinPlayMoleculePlayMolecule v2.0 releaseWith the summer heat already waving goodbye and the batteries charged for a new exciting year, we are proud to announce the release of…Oct 3, 2018Oct 3, 2018