| version 1.12 | version 1.13 |
|---|
| |
| \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 |