ZBHZentrum für Bioinformatik

Prof. Matthias Rarey talks at CSSB-Seminar virtual event about "Next Generation Computational Tools for Structure- and Ligand-Based Design":

https://www.cssb-hamburg.de/news_amp_events/events/cssb_seminar_series___matthias_rarey/index_eng.h...

Fragment growing is an important paradigm in computer-aided drug design. To improve the speed and interactivity of fragment growing workflows, which are often built on old or general purpose tools, we have developed and recently published a...

Der neue SMARTS.plus Webserver bietet neben der Möglichkeit zur Visualisierung komplexer chemischer SMARTS zusätzlich die Möglichkeit des automatisierten Vergleichs, liefert Einblicke in die Ähnlichkeit neuer SMARTS zu bereits publizierten...