Daily Archives: July 19, 2019

The new version of AQUA-DUCT is combining information from small  ligands tracking and from small ligands local distribution. New modes of AQUA-DUCT MD data processing: normal, sandwich, time-window and consolidator mode. Pond module for hot-spots identification facilitating protein engineering and drug design, Energy barrier approximation. Graphical User Interface. Kraken module for fast data analysis. Bug fixes and code cleanup. For more visit an AQUA-DUCT web site.