entryimport
Import structures into the current project.
Syntax: entryimport all= yes | no allfiles= yes | no cifpopulateunitcell= yes | no creategroups= all | none | single customfilter= <text> end= yes | no extradata= yes | no firstonly= yes | no fittoscreen= yes | no format= mol2 | maestro | sd | jaguarinput | gaussinput | biograf | xyz | jaguaroutput | gaussian92 | gaussian94 | gamess | mopaccartesian | mopacinternal | mopacoutput | babelpdb | mdl | babelmol | babelmol2 | gamessinput | gaussianz | jaguarzmatrix | jaguarcartesian | any | reagentprep | mcproinput | cms | maegz | sdcompressed | glideposeviewer | smiles | smilesgz | common | cif | custom | fhiaims | mmcif | phypo | ph4 | fmp | moe | cdx | cdxml | chemdraw | cifuncompressed | densitymap glideposeviewer= yes | no graphical= yes | no map_sd_properties= yes | no mapmaestroproperties= yes | no openprepwizard= yes | no pdbcolorbyconversionstatus= yes | no preservegroups= yes | no sd_mapping_dialog= never sdtitle= propertyname sdtitlepropertyname= <text> start= <n> total= <n> wsinclude= first | all wsreplace= yes | no [[<filename>] ]
Options:
- all
- This determines whether all structures will be imported, or just a specified range.
-
Valid values: boolean (true|false; yes|no; y|n; on|off) Default value: true
- allfiles
- This determines whether all files in the directory given in the operand will be imported.
-
Valid values: boolean (true|false; yes|no; y|n; on|off) Default value: false
- cifpopulateunitcell
- When true, Maestro will automatically populate crystal unit cell in workspace after CIF file import, for imported entries included in Workspace.
-
Valid values: boolean (true|false; yes|no; y|n; on|off) Default value: false
- creategroups
- This option determines which of the imported structures are to be grouped. Valid values are "multiple", "all" or "none".
-
Valid values: multiple
all
none
singleDefault value: multiple
- customfilter
- Stores the custom file filter mentioned by user in the import dialog
-
Valid values: text strings Default value:
- end
- This determines if all structures in the file are to be imported starting from the structure specified by start.
-
Valid values: boolean (true|false; yes|no; y|n; on|off) Default value: false
- extradata
- This option determines whether to import data files associated with imported structures. The additional data file associations are expected to be listed in .smap files having the same base name as the structure files.
-
Valid values: boolean (true|false; yes|no; y|n; on|off) Default value: true
- firstonly
- This option imports only the first structure incase the file format is of Desmond ( .cms ) type.
-
Valid values: boolean (true|false; yes|no; y|n; on|off) Default value: true
- fittoscreen
- This determines whether the newly imported and included structures should be fit to Workspace or not. Deprecated.
-
Valid values: boolean (true|false; yes|no; y|n; on|off) Default value: true
- format
- This option sets the format of the file to be read.
-
Valid values: pdb
mol2
maestro
sd
jaguarinput
gaussinput
biograf
xyz
jaguaroutput
gaussian92
gaussian94
gamess
mopaccartesian
mopacinternal
mopacoutput
babelpdb
mdl
babelmol
babelmol2
gamessinput
gaussianz
jaguarzmatrix
jaguarcartesian
any
reagentprep
mcproinput
cms
maegz
sdcompressed
glideposeviewer
smiles
smilesgz
common
cif
custom
fhiaims
mmcif
phypo
ph4
fmp
moe
cdx
cdxml
chemdraw
cifuncompressed
densitymapDefault value: common
- glideposeviewer
- This option determines whether to setup pose viewer files for viewing poses with the ePlayer. Deprecated.
-
Valid values: boolean (true|false; yes|no; y|n; on|off) Default value: true
- graphical
- [NOTE: This option is no longer used.]
-
Valid values: boolean (true|false; yes|no; y|n; on|off) Default value: true
- map_sd_properties
- Indicates whether or not to map SD properties to existing non-SD properties in the Project Table.
-
Valid values: boolean (true|false; yes|no; y|n; on|off) Default value: false
- mapmaestroproperties
- This option allows mapping of Maestro properties in an input file to different properties in the Project Table.
-
Valid values: boolean (true|false; yes|no; y|n; on|off) Default value: false
- openprepwizard
- This option determines whether to open protein prepwizard panel after importing PDB files. Deprecated.
-
Valid values: boolean (true|false; yes|no; y|n; on|off) Default value: false
- pdbcolorbyconversionstatus
- This option enables coloring PDB files by conversion status upon import.
-
Valid values: boolean (true|false; yes|no; y|n; on|off) Default value: false
- preservegroups
- This option preserves groups within files while import
-
Valid values: boolean (true|false; yes|no; y|n; on|off) Default value: true
- sd_mapping_dialog
- Indicates when the mapping dialog should be brought up
-
Valid values: always
neverDefault value: always
- sdtitle
- The source of titles from a SD format file. Valid values are "moleculename" or "propertyname" .
-
Valid values: moleculename
propertynameDefault value: moleculename
- sdtitlepropertyname
- The property to be used to construct titles from a SD format file, if sdtitle option is "propertyname".
-
Valid values: text strings Default value:
- start
- This option sets the number of the first structure to be imported, if not importing all.
-
Valid values: integers Default value: 1
Minimum: 1 - total
- The total number of structures to be imported from the file, if not importing all structures.
-
Valid values: integers Default value: 1
Minimum: 1 - wsinclude
- This option determines which of the imported structures are to be included in the workspace. Valid values are "none", "first", or "all".
-
Valid values: none
first
allDefault value: first
- wsreplace
- This determines whether the structures currently in the workspace will be replaced by the included imported structures, or whether they will be be included in the workspace also.
-
Valid values: boolean (true|false; yes|no; y|n; on|off) Default value: true
Operands:
[<filename>]
The name of the file from which structures will be imported. If no name is specified, then no import will be done.