Jonathan Hungerland (JonathanHungerland)

JonathanHungerland

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Company:QuantBioLab, University of Oldenburg

Location:Oldenburg, Germany

Home Page:www.quantbiolab.com

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Jonathan Hungerland's starred repositories

grappa

A Machine Learned Molecular Mechanics Force Field with integration into GROMACS and OpenMM

Language:PythonLicense:GPL-3.0Stargazers:25Issues:0Issues:0
Language:ShellStargazers:4Issues:0Issues:0

safep

Tools for Analyzing and Debugging (SA)FEP calculations. See also the SAFEP Tutorial: https://github.com/jhenin/SAFEP_tutorial/tree/main Documentation: https://safep-alchemy.readthedocs.io/en/latest/

Language:Jupyter NotebookLicense:LGPL-2.1Stargazers:3Issues:0Issues:0

alphafold

Open source code for AlphaFold.

Language:PythonLicense:Apache-2.0Stargazers:12153Issues:0Issues:0

gpt-researcher

GPT based autonomous agent that does online comprehensive research on any given topic

Language:PythonLicense:MITStargazers:13326Issues:0Issues:0