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Search results for openbabel
openbabel
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5 search results found
Plip
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320
Protein-Ligand Interaction Profiler - Analyze and visualize non-covalent protein-ligand interactions in PDB files according to 📝 Adasme et al. (2021), https://doi.org/10.1093/nar/gkab294
Oddt
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241
Open Drug Discovery Toolkit
Jupyter_dock
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215
Jupyter Dock is a set of Jupyter Notebooks for performing molecular docking protocols interactively, as well as visualizing, converting file formats and analyzing the results.
Clusttraj
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16
Python script that receives a molecular dynamics or Monte Carlo trajectory and performs agglomerative clustering to classify similar structures.
Poap
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8
Parallelized Open Babel & Autodock suite Pipeline
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1-5 of 5 search results
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