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Dmitrij Rappoport

Showing results (11-20 of 44) with videos related to

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Journal of Chemical Information and Modeling|February 21, 2023
Enzyme Substrate Prediction from Three-Dimensional Feature Representations Using Space-Filling CurvesDmitrij Rappoport, Adrian Jinich
Nanoscale|April 29, 2024
Optical study of Te<sub>8</sub> ring clusters: comparison with density functional theory and a step towards materials design using nanoporous zeolite spaceVladimir Poborchii, Dmitrij Rappoport
Journal of Chemical Theory and Computation|September 5, 2024
Reaction Networks Resemble Low-Dimensional Regular LatticesMiko M Stulajter, Dmitrij Rappoport
Journal of Chemical Theory and Computation|June 28, 2019
Predicting Feasible Organic Reaction Pathways Using Heuristically Aided Quantum ChemistryDmitrij Rappoport, Alán Aspuru-Guzik
Journal of Chemical Theory and Computation|December 13, 2017
Quadratic Response Properties from TDDFT: Trials and TribulationsShane M Parker, Dmitrij Rappoport, Filipp Furche
The Journal of Chemical Physics|May 15, 2023
Implementation of the self-consistent phonons method with ab initio potentials (AI-SCP)Colin Schiltz, Dmitrij Rappoport, Vladimir A Mandelshtam
The Journal of Physical Chemistry Letters|August 22, 2015
Simplified Sum-Over-States Approach for Predicting Resonance Raman Spectra. Application to Nucleic Acid BasesDmitrij Rappoport, Sangwoo Shim, Alán Aspuru-Guzik
Scientific Reports|January 27, 2015
Uncertainty of prebiotic scenarios: the case of the non-enzymatic reverse tricarboxylic acid cycleDmitry Yu Zubarev, Dmitrij Rappoport, Alán Aspuru-Guzik
The Journal of Chemical Physics|June 8, 2026
Prospects for detecting UF6 hydrolysis intermediates by mass spectrometry, resonance Raman, and NQR spectroscopyJesse J Lutz, Dmitrij Rappoport, Louis E McNamara
Dalton Transactions (Cambridge, England : 2003)|November 28, 2023
A DFT perspective on organometallic lanthanide chemistryAhmadreza Rajabi, Robin Grotjahn, Dmitrij Rappoport, et al.
Pageof 5

Showing results (11-20 of 44) with videos related to

Sort By:
Pageof 5
Journal of Chemical Information and Modeling|February 21, 2023
Enzyme Substrate Prediction from Three-Dimensional Feature Representations Using Space-Filling CurvesDmitrij Rappoport, Adrian Jinich
Nanoscale|April 29, 2024
Optical study of Te<sub>8</sub> ring clusters: comparison with density functional theory and a step towards materials design using nanoporous zeolite spaceVladimir Poborchii, Dmitrij Rappoport
Journal of Chemical Theory and Computation|September 5, 2024
Reaction Networks Resemble Low-Dimensional Regular LatticesMiko M Stulajter, Dmitrij Rappoport
Journal of Chemical Theory and Computation|June 28, 2019
Predicting Feasible Organic Reaction Pathways Using Heuristically Aided Quantum ChemistryDmitrij Rappoport, Alán Aspuru-Guzik
Journal of Chemical Theory and Computation|December 13, 2017
Quadratic Response Properties from TDDFT: Trials and TribulationsShane M Parker, Dmitrij Rappoport, Filipp Furche
The Journal of Chemical Physics|May 15, 2023
Implementation of the self-consistent phonons method with ab initio potentials (AI-SCP)Colin Schiltz, Dmitrij Rappoport, Vladimir A Mandelshtam
The Journal of Physical Chemistry Letters|August 22, 2015
Simplified Sum-Over-States Approach for Predicting Resonance Raman Spectra. Application to Nucleic Acid BasesDmitrij Rappoport, Sangwoo Shim, Alán Aspuru-Guzik
Scientific Reports|January 27, 2015
Uncertainty of prebiotic scenarios: the case of the non-enzymatic reverse tricarboxylic acid cycleDmitry Yu Zubarev, Dmitrij Rappoport, Alán Aspuru-Guzik
The Journal of Chemical Physics|June 8, 2026
Prospects for detecting UF6 hydrolysis intermediates by mass spectrometry, resonance Raman, and NQR spectroscopyJesse J Lutz, Dmitrij Rappoport, Louis E McNamara
Dalton Transactions (Cambridge, England : 2003)|November 28, 2023
A DFT perspective on organometallic lanthanide chemistryAhmadreza Rajabi, Robin Grotjahn, Dmitrij Rappoport, et al.
Pageof 5