BioExcel Alchemical Free Energy workshop Philip Fowler, 17th June 2019 Last month I was invited to give a talk on using alchemical free energy methods to predict antimicrobial resistance at a workshop in Göttingen organised by the Max Planck Institute for Biophysical Chemistry on behalf of BioExcel. You can read more about the meeting, which I hope will become a biennial event, here. Share this:TwitterBlueskyEmailLinkedInMastodon Related antimicrobial resistance computing meetings molecular dynamics
GPUs GROMACS 4.6: Scaling of a very large coarse-grained system 23rd October 2013 So if I have a particular system I want to simulate, how many processing cores… Share this:TwitterBlueskyEmailLinkedInMastodon Read More
New publication: Predicting antibiotic resistance in complex protein targets using alchemical free energy methods 26th August 202224th October 2022 In this paper, Alice Brankin calculates how different mutations in the DNA gyrase affect the… Share this:TwitterBlueskyEmailLinkedInMastodon Read More
meetings BPS15: I’m (guest) blogging.. 7th February 20155th August 2018 I was pleased to be chosen as one of the guest bloggers. for the Annual… Share this:TwitterBlueskyEmailLinkedInMastodon Read More