Sciformation ELN kann für folgende Dateiformate Vorschaugrafiken erzeugen und ggf. Daten wie Peaklisten extrahieren (ohne Gewähr):

DateiformatBeispielSchnellauswertung der Daten
Allgemein
PDFVolltext
MS-Office, OpenOfficeVolltext
Grafiken (GIF, JPG, PNG, TIFF, BMP, PCX, TGA, etc.)-
Vektorformate (EMF, SVG, WMF)-
JCAMP-Dateien (unter Verwendung dieser Bibliothek, auch 2D-NMR)Peakliste
DICOM-Dokumente (medizinisch)-
MP4-Videos (abhängig vom verwendeten Codec)Standbilder und Videoplayer
HDF5nur interaktiver Viewer
Strukturen (über JMol)
Röntgenstrukturen (CIF, RES,...)Interaktiver 3D-Betrachter
Quantenchemie (Gaussian, Molden, Molpro, Mopac, XYZ, ZMatrix, Crystal,...)Interaktiver 3D-Betrachter
Moleküldynamik (Gromacs,...)Interaktiver 3D-Betrachter
Biochemie/Bioinformatik (CML, PDB,...)Interaktiver 3D-Betrachter
Chromatographie
Agilent (HTML)Peakliste
AIA/netCDF (unter Verwendung dieser Bibliothek, auch GC-MS)Peakliste, ggf. mit Massen
Metrohm MagIC Net (Ionenchromatographie)Peakliste
Perkin-Elmer GC (experimentell)Peakliste
Shimadzu HPLC (experimentell, LCD-Format nicht unterstützt)

DateiformatBeispielSchnellauswertung der Daten
GC-MS/LC-MS
Agilent ChemstationPeakliste mit Massen
mzMLPeakliste mit Massen
Varian SMSPeakliste mit Massen
IR/Raman
Galactic SPCPeakliste
Perkin-Elmer SPPeakliste
Nicolet SPAPeakliste
Sadtler IRFPeakliste
Bruker Opus
Yokogawa WDFPeakliste
NMR
Bruker 1DPeakliste
Bruker 2DPeakliste
JEOL (in Anlehnung an diese Bibliothek, 2D-NMR experimentell)
Beispieldatei von S. B. Kim et al., https://doi.org/10.7910/DVN/ZAZDNM, CC0
Peakliste
Massenspektren
NIST MSPPeakliste
Waters MGFPeakliste
Waters PUF
EPR/ESR
Bruker BES3T (DTA+DSC)
Beispieldatei von D. Huber et al., CC-BY 4.0
Graph, Parameter
Pulverdiffraktogramme
Bruker, StoePeakliste
Panalytical XRDMLPeakliste
Röntgenfluoreszenzspektroskopie
Aspex TIFFMikroskopaufnahme, Graph, Elementliste, ggf. Quantifizierung
EMSAGraph, Elementliste, ggf. Quantifizierung
Bruker SPXGraph, Elementliste, ggf. Quantifizierung

Alle Angaben ohne Gewähr. Alle Firmennamen und Produktbezeichnungen sind Warenzeichen der jew. Eigentümer.

Sciformation ELN can generate preview images and – in some cases – extract data like peak lists for the following file formats (noncommital, subject to change):

File formatExampleQuick data analysis
General
PDFfull text
MS-Office, OpenOfficefull text
Images (GIF, JPG, PNG, TIFF, BMP, PCX, TGA, etc.)-
Vector formats (EMF, SVG, WMF)-
JCAMP files (using this library, also 2D-NMR)peak list
DICOM documents (medicinal)-
MP4-Videos (depending on codec)still images and video player
HDF5Interactive viewer only
Structure files (via JMol)
X-ray structures (CIF, RES,...)interactive 3D viewer
Quantum chemistry (Gaussian, Molden, Molpro, Mopac, XYZ, ZMatrix, Crystal,...)interactive 3D viewer
Molecular dynamics (Gromacs,...)interactive 3D viewer
Biochemistry/bioinformatics (CML, PDB,...)interactive 3D viewer
Chromatography
Agilent (HTML)peak list
AIA/netCDF (using this library, also GC-MS)peak list, with mass spectra if available
Metrohm MagIC Net (ion chromatography)peak list
Perkin-Elmer GC (experimental)peak list
Shimadzu HPLC (experimental, LCD format not supported)

File formatExampleQuick data analysis
GC-MS/LC-MS
Agilent Chemstationpeak list with mass spectra
mzMLpeak list with mass spectra
Varian SMSpeak list with mass spectra
IR/Raman
Galactic SPCpeak list
Perkin-Elmer SPpeak list
Nicolet SPApeak list
Sadtler IRFpeak list
Bruker Opus
Yokogawa WDFpeak list
NMR
Bruker 1Dpeak list
Bruker 2Dpeak list
JEOL (developed based on this library, 2D NMR experimental)
Sample file by S. B. Kim et al., https://doi.org/10.7910/DVN/ZAZDNM, CC0
peak list
Mass spectra
NIST MSPpeak list
Waters MGFpeak list
Waters PUF
EPR/ESR
Bruker BES3T (DTA+DSC)
Sample file by D. Huber et al., CC-BY 4.0
graph, parameters
X-ray powder diffractograms
Bruker, Stoepeak list
Panalytical XRDMLpeak list
X-ray fluorescence spectroscopy
Aspex TIFFmicroscope image, graph, element list, quantification if possible
EMSAgraph, element list, quantification if possible
Bruker SPXgraph, element list, quantification if possible

No liability can be taken for the completeness and correctness of the information provided. All company and product names are trademarks of their respective owners.