Fig. 3From: Bridging experiment and theory: a template for unifying NMR data and electronic structure calculationsNMRPipe shell scripts used to process simulated (top) and experimental (bottom) \(^{17}\hbox {O}\) NMR data of \((\hbox {NH}_{4})_{4}\hbox {UO}_{2}(\hbox {CO}_{3})_{3}\), with outputs as shown in Fig. 5. These scripts were integrated into the Kepler workflowBack to article page