ChemAxon - Software Solutions and Services for Chemistry & Biology

Total posts by University of California Davis: 12

publication · 2 years ago

A Homodimer Model Can Resolve the Conundrum as to How Cytochrome P450 Oxidoreductase and Cytochrome b5 Compete for the Same Binding Site on Cytochrome P450c17

by Michael W. Parker, Jessica K. Holien, Alan J. Conley, C. Jo Corbin, Raymond J. Rodgers, Lisandra L. Martin (Monash University, University of California Davis, University of Melbourne, University of Adelaide, St. Vincent's Institute of Medical Research)

publication · 5 years ago

LipidBlast Templates As Flexible Tools for Creating New in-Silico Tandem Mass Spectral Libraries

by Tobias Kind, Oliver Fiehn, Yozo Okazaki, Kazuki Saito (University of California Davis, Chiba University)

publication · 8 years ago

How Large Is the Metabolome? A Critical Analysis of Data Exchange Practices in Chemistry

by Tobias Kind, Oliver Fiehn, Martin Scholz (University of California Davis)

poster · 8 years ago

A machine learning pipeline for substructure detection in unknown mass spectra

by Tobias Kind, Oliver Fiehn (University of California Davis)

publication · 8 years ago

Advances in structure elucidation of small molecules using mass spectrometry

by Tobias Kind, Oliver Fiehn (University of California Davis)

publication · 8 years ago

FiehnLib - mass spectral and retention index libraries for metabolomics based on quadrupole and time-of-flight gas chromatography/mass spectrometry

by Tobias Kind, Oliver Fiehn, Gert Wohlgemuth, Do Yup Lee, Yun Lu, Mine Palazoglu, Sevini Shahbaz (University of California Davis)

publication · 8 years ago

Applying in-silico retention index and mass spectra matching for identification of unknown metabolites in accurate mass GC-TOF mass spectrometry

by Tobias Kind, Oliver Fiehn, Sangeeta Kumari, Doug Stevens, Carsten Denkert (University of California Davis, Waters Corp., Charite University Clinics)

publication · 8 years ago

Seven Golden Rules for heuristic filtering of molecular formulas obtained by accurate mass spectrometry

by Tobias Kind, Oliver Fiehn (University of California Davis)

publication · 8 years ago

Software platform virtualization in chemistry research and university teaching

by Tobias Kind, Oliver Fiehn, Tim Leamy, Julie A. Leary (University of California Davis)

publication · 8 years ago

Hardware and Software Challanges for the Newar Future: Structure Elucidation Concepts via Hyphenated Chromatographic Techniques

by Tobias Kind, Michael P. Balogh, Oliver Fiehn (University of California Davis)

publication · 9 years ago

Instant JChem software review

by Tobias Kind (University of California Davis)

presentation · 11 years ago

Cheminformatics approaches for metabolomics research

by Tobias Kind (University of California Davis)