Single-word Selectors: Difference between revisions
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#REDIRECT [[Selection Algebra]] | |||
== Single-word Selectors == | == Single-word Selectors == | ||
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| pol. | | pol. | ||
| All atoms on the polymer (not het). | | All atoms on the polymer (not het). | ||
|- | |||
| backbone | |||
| bb. | |||
| Polymer backbone atoms ''(new in PyMOL 1.6.1)'' | |||
|- | |||
| sidechain | |||
| sc. | |||
| Polymer non-backbone atoms ''(new in PyMOL 1.6.1)'' | |||
|- | |- | ||
| present | | present | ||
| pr. | | pr. | ||
| All atoms with defined coordinates in the current state (used in creating movies) | | All atoms with defined coordinates in the current state (used in creating movies) | ||
|- | |||
| center | |||
| | |||
| Pseudo-atom at the center of the scene | |||
|- | |||
| origin | |||
| | |||
| Pseudo-atom at the origin of rotation | |||
|} | |} | ||
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As the table shows, many single-word selectors have short forms to save on typing. Some short forms must be followed by a period and a space, in order to delimit the word. Short forms and long forms have the same effect, so choose the form that suits you. | As the table shows, many single-word selectors have short forms to save on typing. Some short forms must be followed by a period and a space, in order to delimit the word. Short forms and long forms have the same effect, so choose the form that suits you. | ||
< | <source lang="python"> | ||
PyMOL> color blue, all # It all turns blue. | |||
PyMOL> color blue, * | |||
PyMOL> hide hydro # Representations of all | |||
PyMOL> hide h. # hydrogen atoms are hidden. | |||
PyMOL> show spheres, hetatom # All the atoms defined as HETATOMS | |||
PyMOL> show spheres, het # in the PDB input file | |||
# are represented as spheres. | # are represented as spheres. | ||
</ | </source> | ||
== More selectors == | == More selectors == | ||
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| fixed | | fixed | ||
| fxd. | | fxd. | ||
| | | All fixed atoms. | ||
|- | |- | ||
| restrained | | restrained | ||
| rst. | | rst. | ||
| | | All restrained atoms. | ||
|- | |- | ||
| organic | | organic | ||
| org. | | org. | ||
| | | All atoms in non-polymer organic compounds (e.g. ligands, buffers). | ||
|- | |- | ||
| inorganic | | inorganic | ||
| ino. | | ino. | ||
| | | All non-polymer inorganic atoms/ions. | ||
|- | |- | ||
| solvent | | solvent | ||
| sol. | | sol. | ||
| All water molecules. | | All water molecules. | ||
|- | |||
| guide | |||
| | |||
| All protein CA and nucleic acid C4*/C4' | |||
|- | |||
| metals | |||
| | |||
| All metal atoms ''(new in PyMOL 1.6.1)'' | |||
|} | |} | ||
Latest revision as of 06:55, 21 November 2017
Redirect to:
Single-word Selectors
The very simplest selection-expressions are single-word selectors. These selectors do not take identifiers; they are complete by themselves. Below are some commonly used single-word selectors.
Single-Word Selector | Short-Form Selector | Description |
---|---|---|
all | * | All atoms currently loaded into PyMOL |
none | none | No atoms (empty selection) |
hydro | h. | All hydrogen atoms currently loaded into PyMOL |
hetatm | het | All atoms loaded from Protein Data Bank HETATM records |
visible | v. | All atoms in enabled objects with at least one visible representation |
polymer | pol. | All atoms on the polymer (not het). |
backbone | bb. | Polymer backbone atoms (new in PyMOL 1.6.1) |
sidechain | sc. | Polymer non-backbone atoms (new in PyMOL 1.6.1) |
present | pr. | All atoms with defined coordinates in the current state (used in creating movies) |
center | Pseudo-atom at the center of the scene | |
origin | Pseudo-atom at the origin of rotation |
The selector none won't come up much when you are typing commands directly into PyMOL, but it is useful in programming scripts.
As the table shows, many single-word selectors have short forms to save on typing. Some short forms must be followed by a period and a space, in order to delimit the word. Short forms and long forms have the same effect, so choose the form that suits you.
PyMOL> color blue, all # It all turns blue.
PyMOL> color blue, *
PyMOL> hide hydro # Representations of all
PyMOL> hide h. # hydrogen atoms are hidden.
PyMOL> show spheres, hetatom # All the atoms defined as HETATOMS
PyMOL> show spheres, het # in the PDB input file
# are represented as spheres.
More selectors
Single-Word Selector | Short-Form Selector | Description |
---|---|---|
enabled | All enabled objects or selections from the object list. | |
masked | msk. | All masked atoms. |
protected | pr. | All protected atoms. |
bonded | All bonded atoms | |
donors | don. | All hydrogen bond donor atoms. |
acceptors | acc. | All hydrogen bond acceptor atoms. |
fixed | fxd. | All fixed atoms. |
restrained | rst. | All restrained atoms. |
organic | org. | All atoms in non-polymer organic compounds (e.g. ligands, buffers). |
inorganic | ino. | All non-polymer inorganic atoms/ions. |
solvent | sol. | All water molecules. |
guide | All protein CA and nucleic acid C4*/C4' | |
metals | All metal atoms (new in PyMOL 1.6.1) |