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Search results for chemistry molecular structures
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molecular-structures
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8 search results found
Lightdock
⭐
234
Protein-protein, protein-peptide and protein-DNA docking framework based on the GSO algorithm
Stk
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214
A Python library which allows construction and manipulation of complex molecules, as well as automatic molecular design and the creation of molecular databases.
Ani1_dataset
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71
A data set of 20 million calculated off-equilibrium conformations for organic molecules
Pycontact
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34
Analysis of non-covalent interactions in MD trajectories
Stk Vis
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23
A cross-platform application for visualization of molecular databases.
Molecular Vae
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19
Pytorch implementation of the paper "Automatic Chemical Design Using a Data-Driven Continuous Representation of Molecules"
Glados
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18
New Web Interface for ChEMBL @ EMBL-EBI
Mol Draw
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8
A lightweight, 3D molecular viewer for JavaScript and PureScript applications.
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1-8 of 8 search results
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