version 1.15 | version 1.16 |
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\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{velocities}{Return x, y, z velocities for the given atom.}\\ |
\KEYDEF{mass}{Return the mass of the given atom.}\\ | \KEYDEF{mass}{Return the mass of the given atom.}\\ |
| \KEYDEF{charge}{Return the charge of the given atom.}\\ |
\KEYDEF{atomid}{Return the one-based atomid of the given atom. These are only assigned/updated when writing a file. Therefore {\tt writepsf}, {\tt writepdb}, or {\tt writemol} must be called to avoid returning old atomid values or zero.}\\ | \KEYDEF{atomid}{Return the one-based atomid of the given atom. These are only assigned/updated when writing a file. Therefore {\tt writepsf}, {\tt writepdb}, or {\tt writemol} must be called to avoid returning old atomid values or zero.}\\ |
\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.}\\ |