Closed ryanmcgreevy closed 6 years ago
@trudack multiple map support is now in, and a new -gridpdbsel
option is available to change from the default selection text. Both the -density
and -gridpdbseloptions will take either 1 argument, or a list. You can still omit the
-gridpdbseloption to use the default selections, even if using multiple maps. If you choose to use the
-gridpdbsel` option, however, then you must have one in the list for each input map.
Allow
quick_mdff
to work on multiple input maps and gridpdb atom selections.