Dictionary home | Supergroups | Saveframe categories | Tag categories | Tags

_Conformer_stat_list.Both_ensemble_and_rep_conformer

DescriptionSelect this box if your atomic coordinate file contains data for an ensemble of conformers and a representative conformer derived using a method different from that used for the other conformers in the file. An example would be a file that contains an en
Details:
Parent saveframeconformer_statistics
Data typeyes_no
 
DB tableConformer_stat_list
DB columnBoth_ensemble_and_rep_conformer
DB typeBOOLEAN
NULL allowedno (mandatory)
 
ADIT-NMR deposition system promptAre you depositing coordinates for both an ensemble of conformers and an independently derived representative conformer derived from the ensemble?