easyspin routine (pepper function) (MathWorks Inc)
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Easyspin Routine (Pepper Function), supplied by MathWorks Inc, used in various techniques. Bioz Stars score: 90/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
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Comparison:Article Title: I 2 BODIPY as a new photoswitchable spin label for light-induced pulsed EPR dipolar spectroscopy exploiting magnetophotoselection Article Snippet: The spin Hamiltonian parameters used to simulate the EPR spectrum of the nitroxide radical were obtained from fitting the echo-detected field-swept spectrum (Fig. 2 (a)), using the Article Title: I 2 BODIPY as a new photoswitchable spin label for light-induced pulsed EPR dipolar spectroscopy exploiting magnetophotoselection Article Snippet: The Article Title: Determining and controlling conformational information from orientationally selective light-induced triplet–triplet electron resonance spectroscopy for a set of bis-porphyrin rulers Article Snippet: Figure S2. trESR spectrum of [3] at 20 K measured after laser flash (black) and simulation (red) using the Article Title: I 2 BODIPY as a new photoswitchable spin label for light-induced pulsed EPR dipolar spectroscopy exploiting magnetophotoselection Article Snippet: Electron spin-echo field-swept spectrum of 1 in the dark (black) and simulation (red) using the Article Title: Determining and controlling conformational information from orientationally selective light-induced triplet–triplet electron resonance spectroscopy for a set of bis-porphyrin rulers Article Snippet: The spin Hamiltonian parameters for the photoexcited triplet state were extracted via simulation of the spectrum (Fig. S2, ESI ) using the Article Title: Determining and controlling conformational information from orientationally selective light-induced triplet–triplet electron resonance spectroscopy for a set of bis-porphyrin rulers Article Snippet: As input to this PDS simulation algorithm, the spin system parameters were obtained from fitting trESR or echo-detected field sweep datasets (Fig. S2, ESI and ) using a Article Title: I 2 BODIPY as a new photoswitchable spin label for light-induced pulsed EPR dipolar spectroscopy exploiting magnetophotoselection Article Snippet: Simulation (red) using the |
![Orientational DEER study of Cu 2 -[3] at Q-band. (a) Echo-detected field-swept ESR spectrum (black) and simulation (red) using the Matlab® <t>EasySpin</t> routine (pepper function), with spin Hamiltonian parameters: g = [2.041, 2.051, 2.191], A 65 Cu = [72, 89, 639] MHz and l w = [2, 2] mT. The field positions used to record the DEER traces are indicated with vertical lines. (b) Background-corrected and modulation depth-normalised DEER traces acquired at the different field positions (colour) and corresponding orientation-dependent fits (black). Modulation depths were ∼2–3% before normalization in all cases. (c) Distance distributions obtained from the orientation-dependent analysis of the DEER (black) and LITTER (red) datasets. In each case the center-to-center distribution of distances are plotted as dashed lines and the point dipole distribution of distance distribution calculated from pairwise distances of atoms possessing spin density on different chromophores is shown as a solid line. (d) DFT-optimised geometry showing the different positions of the CuTPP centre most contributing to the fit as gey spheres, relative to the g -tensor frame of the other CuTPP (arrows: red = g x , green = g y , blue = g z ). The diameter of the spheres is proportional to the number of times a single conformation contributes to the complete fit shown in panel (b). A rotated view is provided in Fig. S11 (ESI ). The TPP centre positions from have been included for comparison (red).](https://pub-med-central-images-cdn.bioz.com/pub_med_central_ids_ending_with_3979/pmc10793979/pmc10793979__d3cp03454b-f3.jpg)