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English
The prediction of the circular dichroism of the benzene chromophore: TDDFT calculations and sector rules
scientific article published in 2008
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scholarly article
1 reference
stated in
Europe PubMed Central
PubMed publication ID
17724654
reference URL
https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:17724654%20AND%20SRC:MED&resulttype=core&format=json
retrieved
4 January 2020
title
The prediction of the circular dichroism of the benzene chromophore: TDDFT calculations and sector rules
(English)
1 reference
stated in
Europe PubMed Central
PubMed publication ID
17724654
reference URL
https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:17724654%20AND%20SRC:MED&resulttype=core&format=json
retrieved
4 January 2020
author
Gennaro Pescitelli
series ordinal
1
1 reference
stated in
Europe PubMed Central
PubMed publication ID
17724654
reference URL
https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:17724654%20AND%20SRC:MED&resulttype=core&format=json
retrieved
4 January 2020
Lorenzo Di Bari
series ordinal
2
1 reference
stated in
Europe PubMed Central
PubMed publication ID
17724654
reference URL
https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:17724654%20AND%20SRC:MED&resulttype=core&format=json
retrieved
4 January 2020
author name string
Anna Maria Caporusso
series ordinal
3
1 reference
stated in
Europe PubMed Central
PubMed publication ID
17724654
reference URL
https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:17724654%20AND%20SRC:MED&resulttype=core&format=json
retrieved
4 January 2020
Piero Salvadori
series ordinal
4
1 reference
stated in
Europe PubMed Central
PubMed publication ID
17724654
reference URL
https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:17724654%20AND%20SRC:MED&resulttype=core&format=json
retrieved
4 January 2020
publication date
1 March 2008
1 reference
stated in
Europe PubMed Central
PubMed publication ID
17724654
reference URL
https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:17724654%20AND%20SRC:MED&resulttype=core&format=json
retrieved
4 January 2020
published in
Chirality
1 reference
stated in
Europe PubMed Central
PubMed publication ID
17724654
reference URL
https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:17724654%20AND%20SRC:MED&resulttype=core&format=json
retrieved
4 January 2020
volume
20
1 reference
stated in
Europe PubMed Central
PubMed publication ID
17724654
reference URL
https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:17724654%20AND%20SRC:MED&resulttype=core&format=json
retrieved
4 January 2020
issue
3-4
1 reference
stated in
Europe PubMed Central
PubMed publication ID
17724654
reference URL
https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:17724654%20AND%20SRC:MED&resulttype=core&format=json
retrieved
4 January 2020
page(s)
393-399
1 reference
stated in
Europe PubMed Central
PubMed publication ID
17724654
reference URL
https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:17724654%20AND%20SRC:MED&resulttype=core&format=json
retrieved
4 January 2020
cites work
Single-reference ab initio methods for the calculation of excited states of large molecules
1 reference
stated in
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reference URL
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retrieved
7 January 2021
based on heuristic
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Bioactive Natural Products from the Endophytic FungusAscochyta sp. from Meliotus dentatus – Configurational Assignment by Solid-State CD and TDDFT Calculations
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Crossref
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7 January 2021
based on heuristic
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Absolute Configurations of Globosuxanthone A and Secondary Metabolites fromMicrodiplodia sp. – A Novel Solid-State CD/TDDFT Approach
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Crossref
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7 January 2021
based on heuristic
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Secondary Metabolites Isolated from an EndophyticPhoma sp. – Absolute Configuration of Tetrahydropyrenophorol Using the Solid-State TDDFT CD Methodology
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Crossref
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7 January 2021
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Massarilactones E-G, new metabolites from the endophytic fungusConiothyrium sp., associated with the plantArtimisia maritima
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7 January 2021
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Synthesis, resolution, and absolute configuration of two novel and selective cyclooxygenase-2 inhibitors based on the 1,5-diarylpyrrole structure
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7 January 2021
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Substantial errors from time-dependent density functional theory for the calculation of excited states of large pi systems
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7 January 2021
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A global investigation of excited state surfaces within time-dependent density-functional response theory
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https://api.crossref.org/works/10.1002%2FCHIR.20460
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7 January 2021
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Density functional calculations of the vibronic structure of electronic absorption spectra
1 reference
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Crossref
reference URL
https://api.crossref.org/works/10.1002%2FCHIR.20460
retrieved
7 January 2021
based on heuristic
inferred from DOI database lookup
Chiroptical Properties of the Benzene Chromophore. A Method for the Determination of the Absolute Configurations of Benzene Compounds by Application of the Benzene Sector and Benzene Chirality Rules
1 reference
stated in
Crossref
reference URL
https://api.crossref.org/works/10.1002%2FCHIR.20460
retrieved
7 January 2021
based on heuristic
inferred from DOI database lookup
Density functional theory calculations of optical rotation: employment of ADZP and its comparison with other basis sets
1 reference
stated in
Crossref
reference URL
https://api.crossref.org/works/10.1002%2FCHIR.20460
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7 January 2021
based on heuristic
inferred from DOI database lookup
Analysis of vibrational structure in the near-ultraviolet circular dichroism and absorption spectra of phenylalanine and its derivatives
1 reference
stated in
Crossref
reference URL
https://api.crossref.org/works/10.1002%2FCHIR.20460
retrieved
7 January 2021
based on heuristic
inferred from DOI database lookup
Density functional theory calculation of electronic circular dichroism using London orbitals
1 reference
stated in
Crossref
reference URL
https://api.crossref.org/works/10.1002%2FCHIR.20460
retrieved
7 January 2021
based on heuristic
inferred from DOI database lookup
Identifiers
DOI
10.1002/CHIR.20460
1 reference
stated in
Europe PubMed Central
PubMed publication ID
17724654
reference URL
https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:17724654%20AND%20SRC:MED&resulttype=core&format=json
retrieved
4 January 2020
PubMed publication ID
17724654
1 reference
stated in
Europe PubMed Central
PubMed publication ID
17724654
reference URL
https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:17724654%20AND%20SRC:MED&resulttype=core&format=json
retrieved
4 January 2020
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