An excellent possibility to get insights how AQUA-DUCT can help with enzymes engineering was presented by Agata one f the AQUA-DUCT developer during poster session and pitch talk at Wageningen.
Our webinar on MOLECULAR DYNAMICS SIMULATIONS ANALYSIS WITH MOLECULAR PROBES was held twice on 23rd of September 2020. Now you can watch the recorded video published on our YouTube channel.
The AQUA-DUCT webinar was held on 23rd September 2020. Thank you for participation.
The SUMMER SCHOOL OF MOLECULAR DYNAMIC SIMULATIONS ANALYSIS WITH MOLECULAR PROBES is postpone due to COVID-19 pandemic. We will keep you updated. We are planning to set new deadlines and schedules for the event. Preliminary, the REGISTRATION deadline is set on 1.07.2020 and the SUMMER SCHOOL will take place in October.
25th of July, AQUA-DUCT will be presented during lecture in Heidelberg Institute for Theoretical Studies. It will be first presentation of new version of AQUA-DUCT.
The AQUA-DUCT software was used for loop functionality analysis.
AQUA-DUCT will be presented during School on molecular computational biochemistry that will take on 11-14 March place in the Jerzy Haber Institute of Catalysis and Surface Chemistry in Kraków.
AQUA-DUCT was presented on FEBS congress during speed-talk session Biochemistry and Signaling held on Monday, July 9, 2018. To facilitate analysis of the behaviour of water (and if necessary other solvent molecules or ligands) we have developed AQUA-DUCT. Here we would like to provide an example of its usage for analysis of water transportation in selected enzymes (epoxide hydrolases…
AQUA-DUCT software will be presented in September during seventeenth edition of the European Conference on Computational Biology in Athens in Greece. It will be presented during ECCB 2018 Application Track part of he conference. The aim of the track is to give a voice to those who apply computational biology in industry, clinics, governmental organizations, and other fields beyond…
The AQUA-DUCT presentation was selected for speed talk and will be presented during 43rd FEBS congress held in Praha, Czech Republick, 2-7 July 2018.
AQUA-DUCT software and its results will be presented during Artificial Water Channels Faraday Discussion organised by Royal Society of Chemistry. Event is organised in Glasgow UK 25-27.062018.
AQUA-DUCT software and its results will be presented during Enzymes, biocatalysis and chemical biology: The new frontiers organised by EMBO in Pavia, Italy 9-12 09 2018.
The AQUA-DUCT workshop took place during 10th Edition of International Conference on Structural Biology 15-16 March, Barcelona