Results 241 to 250 of about 27,432 (257)

Computer-assisted structure elucidation: application of CISOC-SES to the resonance assignment and structure generation of betulinic acid

Magnetic Resonance in Chemistry, 1998
Harry H S Fong
exaly  

Enhancing computer‐assisted structure elucidation with DFT analysis of J‐couplings

Magnetic Resonance in Chemistry, 2020
Alexei V Buevich, Mikhail E Elyashberg
exaly  

Computer‐Assisted 3D Structure Elucidation (CASE‐3D): The Structural Value of 2JCH in Addition to 3JCH Coupling Constants

Angewandte Chemie - International Edition, 2020
Martin R M Koos, Armando Navarro-Vázquez, Clemens Anklin   +2 more
exaly  

Applying Computer-Assisted Structure Elucidation Algorithms for the Purpose of Structure Validation: Revisiting the NMR Assignments of Hexacyclinol

Journal of Natural Products, 2008
Antony John Williams
exaly  

Computer‐Assisted 3D Structure Elucidation of Natural Products using Residual Dipolar Couplings

Angewandte Chemie - International Edition, 2017
Eduardo Troche-Pesqueira, Clemens Anklin, Roberto R. Gil   +2 more
exaly  

Computer-assisted structure elucidation based on spectroscopy

AIP Conference Proceedings, 1995
openaire   +1 more source

SENECA:  A Platform-Independent, Distributed, and Parallel System for Computer-Assisted Structure Elucidation in Organic Chemistry

Journal of Chemical Information and Computer Sciences, 2001
Christoph C Steinbeck
exaly  

Computationally-assisted discovery and structure elucidation of natural products

Journal of Natural Medicines, 2019
Alfarius Eko Nugroho, Hiroshi Morita
exaly  

Computer-Assisted 3D Structure Elucidation (CASE-3D) of Natural Products Combining Isotropic and Anisotropic NMR Parameters

Journal of Natural Products, 2018
Armando Navarro-Vázquez, Roberto R. Gil, Kirill A Blinov   +2 more
exaly  

Specification and unconstrained enumeration of conformations of chemical structures for computer-assisted structure elucidation

Journal of Chemical Information and Computer Sciences, 1981
openaire   +1 more source