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Questions related from Julian M. Kleber
Hello, I was wondering if you could recommend any libraries for MD simulations of proteins with ligands in Python. They may also be accessible via bash. They need to be available for free in...
29 March 2021 6,100 5 View
Hello, I have the feeling that everything in chemistry related to information and data in particular is very sharded and obscured. Are there any projects ensuring more transparency and openess...
23 October 2020 8,742 4 View
Hello, We are working on a project related to surface chemistry and spectroscopy. For this purpose, we want to build a database with chemical structures and related properties. We would prefer...
08 October 2020 3,126 4 View
