pypi.org "normal-modes" keyword
pyqrc 2.4.0
A Python program to project computed structures along normal modes for Quick Reaction Coordinate ...4 versions - Latest release: about 1 month ago - 1 dependent repositories - 60 downloads last month - 45 stars on GitHub - 1 maintainer
frequenpy 0.2.1
Physics engine for standing waves2 versions - Latest release: almost 8 years ago - 1 dependent repositories - 24 downloads last month - 9 stars on GitHub - 1 maintainer
pyadmd 3.4.0
Adaptive Molecular Dynamics with Excited Normal Modes (aMDeNM) on OpenMM.8 versions - Latest release: about 1 month ago - 270 downloads last month - 0 stars on GitHub - 1 maintainer
posym 1.3.2
posym module30 versions - Latest release: 3 months ago - 1 dependent repositories - 1.81 thousand downloads last month - 22 stars on GitHub - 1 maintainer
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symmetry
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molecular symmetry
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group theory
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continuous
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python
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wave-function
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molecular dynamics
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normal modes
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aMDeNM
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OpenMM
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enhanced sampling
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charmm
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elastic-network-models
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enm
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molecular-dynamics
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molecular-dynamics-simulation
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molecular-modeling
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