Results 231 to 240 of about 146,160 (249)

Integrated ¹³C-NMR, ¹H-NMR, IR, MS, and UV/Vis spectral database for spectra prediction and structure elucidation

1996
openaire   +2 more sources

Reference database of Raman spectra of biological molecules

Journal of Raman Spectroscopy, 2007
Peter Vandenabeele, Peter Vandenabeele
exaly  

Effective method for the computation of optical spectra of large molecules at finite temperature including the Duschinsky and Herzberg–Teller effect: The Qx band of porphyrin as a case study

Journal of Chemical Physics, 2008
Fabrizio Santoro, Roberto Improta, Julien Bloino   +2 more
exaly  

Monte Carlo calculation of nine megavoltage photon beam spectra using the BEAM code

Medical Physics, 2002
A Stabile
exaly  

Förster resonance energy transfer, absorption and emission spectra in multichromophoric systems. I. Full cumulant expansions and system-bath entanglement

Journal of Chemical Physics, 2015
Jianshu Cao
exaly  

Faculty Opinions recommendation of SPINS: standardized protein NMR storage. A data dictionary and object-oriented relational database for archiving protein NMR spectra.

Faculty Opinions – Post-Publication Peer Review of the Biomedical Literature, 2003
openaire   +1 more source

Efficient and automatic calculation of optical band shapes and resonance Raman spectra for larger molecules within the independent mode displaced harmonic oscillator model

Journal of Chemical Physics, 2012
Taras Petrenko, Frank Neese
exaly  

Comparison of Experimental and Calculated Chiroptical Spectra for Chiral Molecular Structure Determination

Chirality, 2014
Prasad L Polavarapu
exaly  

The anharmonic quartic force field infrared spectra of three polycyclic aromatic hydrocarbons: Naphthalene, anthracene, and tetracene

Journal of Chemical Physics, 2015
Alessandra Candian, Wybren Jan Buma, Cameron J Mackie   +2 more
exaly  

Impact of environmentally induced fluctuations on quantum mechanically mixed electronic and vibrational pigment states in photosynthetic energy transfer and 2D electronic spectra

Journal of Chemical Physics, 2015
Yuta Fujihashi, Graham R Fleming, Akihito Ishizaki   +2 more
exaly