Search Results for :

CP2K

QM/MM with GROMACS & CP2K Most biochemical systems, such as enzymes, are too large to be described at any level of ab initio or density functional theory. At the same… [...]

Alchemical Free Energy Workshop 2019

27 May, 2019 – 28 May, 2019 @ All Day – Welcome to the European Alchemical Free Energy Workshop on 27-28 May 2019. If you are involved in drug design or biotech research, you may be familiar with the biennial Alchemical Free Energy workshops in the US. Based on the positive feedback from the workshop we co-organised in 2017, from this year, BioExcel, the leading European […] [...]

BioExcel Summer School on Biomolecular Simulations 2019

30 Jun, 2019 – 05 Jul, 2019 @ All Day – Date: Sunday 30 June – Friday 5 July 2019 Venue: Science and Technology Park of Sardinia, Pula, Italy Application opens: 18th February 2019 Application deadline: 26th April 2019 Notification date: 10th May 2019 Participation: Open application with selection Contact: Michelle Mendonca Registration fee: £394 (includes accommodation, all meals and transport to/from the airport & course venue) -Registrations now closed- Overview  The […] [...]