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Folder: chempy
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.. (parent) | |||
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d | rwxr-xr-x | 113 | bmin |
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d | rwxr-xr-x | 101 | champ |
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d | rwxr-xr-x | 32 | fast |
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d | rwxr-xr-x | 32 | fragments |
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d | rwxr-xr-x | 48 | mmtf |
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d | rwxr-xr-x | 113 | tinker |
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- | rw-r--r-- | 16,140 | __init__.py |
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- | rw-r--r-- | 1,354 | arc.py |
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- | rw-r--r-- | 4,747 | bond_amber.py |
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- | rw-r--r-- | 4,205 | bond_mmff.py |
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- | rw-r--r-- | 24,301 | bonds.py |
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- | rw-r--r-- | 2,038 | brick.py |
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- | rw-r--r-- | 2,177 | cc1.py |
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- | rw-r--r-- | 4,119 | charge.py |
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- | rw-r--r-- | 25,533 | cif.py |
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- | rw-r--r-- | 13,742 | cpv.py |
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- | rw-r--r-- | 25,066 | dictdb.py |
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- | rw-r--r-- | 22,412 | gamess1.py |
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- | rw-r--r-- | 3,081 | gms.py |
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- | rw-r--r-- | 8,020 | hetatm.py |
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- | rw-r--r-- | 1,268 | io.py |
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- | rw-r--r-- | 1,183 | lst.py |
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- | rw-r--r-- | 12,252 | mae.py |
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- | rw-r--r-- | 1,898 | map.py |
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- | rw-r--r-- | 1,496 | mass.py |
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- | rw-r--r-- | 7,665 | mmd.py |
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- | rw-r--r-- | 24,524 | models.py |
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- | rw-r--r-- | 4,850 | mol.py |
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- | rw-r--r-- | 3,776 | mol2.py |
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- | rw-r--r-- | 2,428 | neighbor.py |
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- | rw-r--r-- | 3,764 | pdb.py |
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- | rw-r--r-- | 3,687 | pkl.py |
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- | rw-r--r-- | 14,842 | place.py |
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- | rw-r--r-- | 19,157 | protein.py |
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- | rw-r--r-- | 83,108 | protein_amber.py |
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- | rw-r--r-- | 83,144 | protein_amber99.py |
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- | rw-r--r-- | 75,546 | protein_mmff.py |
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- | rw-r--r-- | 140,484 | protein_residues.py |
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- | rw-r--r-- | 5,347 | sdf.py |
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- | rw-r--r-- | 2,077 | solvate.py |
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- | rw-r--r-- | 1,096 | water_amber.py |
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- | rw-r--r-- | 1,450 | water_residues.py |
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- | rw-r--r-- | 3,120 | xyz.py |