version 1.12 | version 1.13 |
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\OKEY{resids} \OKEY{residue} \OKEY{first} \OKEY{last} are used to query | \OKEY{resids} \OKEY{residue} \OKEY{first} \OKEY{last} are used to query |
information about the specified segment.} | information about the specified segment.} |
{\KEYDEF{segids}{Return a list of segids for the molecule in the current context.}\\ | {\KEYDEF{segids}{Return a list of segids for the molecule in the current context.}\\ |
\KEYDEF{resids}{Return a list of resids for the molecule in the current context.}\\ | \KEYDEF{resids}{Return a list of resids for the given segment in the current context.}\\ |
\KEYDEF{residue}{Return the residue name of the residue in | \KEYDEF{residue}{Return the residue name of the residue in the given segment with the given resid.}\\ |
the given segment with the given resid.}\\ | |
\KEYDEF{atoms}{Return a list of atoms for the given segment with the given resid.}\\ | \KEYDEF{atoms}{Return a list of atoms for the given segment with the given resid.}\\ |
\KEYDEF{coordinates}{Return x, y, z coordinates for the given atom.}\\ | \KEYDEF{coordinates}{Return x, y, z coordinates for the given atom.}\\ |
| \KEYDEF{velocities}{Return x, y, z velocities for the given atom.}\\ |
| \KEYDEF{mass}{Return the mass of the given atom.}\\ |
| \KEYDEF{atomid}{Return the atomid of the given atom. These are only assigned during/after writing a PDB file. If {\tt writepdb} has not been called, this will just return zero for all atoms.}\\ |
\KEYDEF{first}{Returns the name of the patch that was applied | \KEYDEF{first}{Returns the name of the patch that was applied |
to the beginning of the specified segment.}\\ | to the beginning of the specified segment.}\\ |
\KEYDEF{last}{Returns the name of the patch that was applied | \KEYDEF{last}{Returns the name of the patch that was applied |