Software
DATAMAN runs on all linux computers.
Source /joule2/programs/login type "dataman" Useful for calculating twinning statistics using Padilla Yeates algorithm (PY_STATS). You can read in a data set and convert to different formats
File type: Default format: Free format? Rfree-flag?
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SHELXS (3i4,2f8.2) no no
PROTEIN (3i6,f10.3) yes no
MKLCF (3i6,2i10) yes no
HKLFS (3i6,2f10.3) yes no
RFREE (3i6,2f10.3,i2) yes yes
ELEANOR (3i6,2f10.3,f4.1) yes (1.0-flag)
XPLOR fixed XPLOR fmt no no
X-PLOR [same as XPLOR] no no
RXPLOR fixed XPLOR fmt no yes
RX-PLOR [same as RXPLOR] no yes
CNS fixed CNS fmt no yes
XCNS fixed CNS fmt no no
TNT fixed TNT format no no
CIF economical no yes (o/f)
OHKL fixed OHKL format no no
* [same as HKLFS] yes no
Absences will list systematic absences. you will see a list of options.
