8 lines
448 B
Plaintext
8 lines
448 B
Plaintext
MDTraj is a python library that allows users to manipulate molecular
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dynamics(MD) trajectories and perform a variety of analyses, including
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fast RMSD, solvent accessible surface area, hydrogen bonding, etc.
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A highlight of MDTraj is the wide variety of molecular dynamics trajectory
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file formats which are supported, including RCSB pdb, GROMACS xtc, tng,
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and trr, CHARMM/NAMD dcd, AMBER binpos, AMBER NetCDF, AMBER mdcrd,
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TINKER arc and MDTraj HDF5
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