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Atomman
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30
Atomistic Manipulation Toolkit
Prosettac
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14
Hexlite
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12
Python-based HEX implementation for a fragment of the HEX language and a subset of features.
Buildh
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9
💻 Build hydrogen atoms from united-atom molecular dynamics of lipids and calculate the order parameters.
Macos Bootstrap
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8
Bootstrap a fresh Catalina MacBook Pro
Django Machine Learning Beta
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7
Fluorify
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6
Computational fluorine scanning built on OpenMM with Python.
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