Evidence map›Paper›PMID 31528957›Full record

ArticlePhysical chemistry chemical physics : PCCP2019

Theoretical studies on the energy structures and optical properties of copper cysteamine - a novel sensitizer.

Marc Alias, Noura D Alkhaldi, Mar Reguero, Lun Ma, Junying Zhang, Coen de Graaf, Muhammad N Huda, Wei Chen

Abstract read
In one paragraph

Article in Physical chemistry chemical physics : PCCP, 2019. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 5 papers, 1 of them a synthesis that pooled it.

0numbers the graph read from it
0cells of the map it votes in
5citing papers in PubMed, 1 pooled it
–field-weighted citation impact
1 · What the graph read from it

What it found

Each row is one number read from the abstract, on the scale the paper reported it, with its interval. Left of the dashed line favours the treatment, right favours the comparator. Under each row is the sentence it came from. New to these charts? A ten-minute tutorial.

The abstract states no effect estimate the extractor could read, or names no intervention and outcome on the map, so this paper lights no cell and moves no belief. It is still indexed, cited and linked below.

2 · The registry

The trial behind it

Trials whose registry record cites this paper, or whose number appears in the abstract. A trial that started after this paper was published is citing it as background, not reporting it.

Neither the registry nor the abstract names a trial number. If this is a trial report, that itself is worth knowing.

3 · Its place in the literature

Who cites it

5 citing papers in PubMed, 1 synthesis or guideline pooled it.

  1. Pooled it
  2. Article
  3. Article
  4. Article
  5. A powerful combination of copper-cysteamine nanoparticles with potassium iodide for bacterial destruction.Materials science & engineering. C, Materials for biological applications · 2020
    Article
4 · The record

Corrections and comments

PubMed lists nothing against this paper. Absence here is not a guarantee, only a check that was made.

5 · Who and what money

Authors and funding

8 authors.

Marc AliasDepartament de Química Física i Inorgànica, Universitat Rovira i Virgili, 43007, Tarragona, Spain. mar.reguero@urv.cat.
Noura D AlkhaldiDepartment of Physics, The University of Texas at Arlington, Arlington, Texas 76019-0059, USA. weichen@uta.edu huda@uta.edu.
Mar RegueroDepartament de Química Física i Inorgànica, Universitat Rovira i Virgili, 43007, Tarragona, Spain. mar.reguero@urv.cat.
Lun MaDepartment of Physics, The University of Texas at Arlington, Arlington, Texas 76019-0059, USA. weichen@uta.edu huda@uta.edu.
Junying ZhangDepartment of Physics, Beihang University, Beijing 100191, China.ORCID http://orcid.org/0000-0002-4860-8774
Coen de GraafDepartament de Química Física i Inorgànica, Universitat Rovira i Virgili, 43007, Tarragona, Spain. mar.reguero@urv.cat and ICREA, Pg. Lluís Companys 23, 08010, Barcelona, Spain.
Muhammad N HudaDepartment of Physics, The University of Texas at Arlington, Arlington, Texas 76019-0059, USA. weichen@uta.edu huda@uta.edu.ORCID http://orcid.org/0000-0002-2655-498X
Wei ChenDepartment of Physics, The University of Texas at Arlington, Arlington, Texas 76019-0059, USA. weichen@uta.edu huda@uta.edu.ORCID http://orcid.org/0000-0002-6989-9830

Funding

Boosting photo-induced cancer therapies through real-time image guidanceR15CA199020 · NCI · UNIVERSITY OF TEXAS ARLINGTON · PI JIN, MINGWU · 2016 to 2016
$415k
NCI NIH HHS R15 CA199020
6 · The paper itself

Abstract

Copper cysteamine (Cu-Cy) is a new type of photosensitizer, which can be activated not only by ultraviolet light, but also by X-rays, microwaves and ultrasound to generate reactive oxygen species for treating cancer and infection diseases. Moreover, copper cysteamine has a strong luminescence, which can be used for both therapeutics and imaging. In addition, it can also be used for solid state lighting, radiation detection and sensing. However, its electronic structures, and particularly its excited states, are not yet clear. Here, we present a computational study aiming to determine the nature of the excited states involved in the photophysical processes that lead to the luminescence of this compound. This study has been conducted using density functional theory (DFT), using both hybrid functionals and time-dependent DFT. It is found that both absorption and emission involve the replacement of an electron among the 3d and 4s orbitals of one or the other of the two types of Cu atoms found in the system. Our computed results compared well with the experimental absorption and emission results. These results are very helpful for the understanding of the experimental observations.

Identifiers

PMID31528957
PMCPMC7439251

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Registered trials

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Read under generation 80e0d062 · epoch 390. Bibliography from PubMed, PubMed Central and OpenAlex; grants from NIH RePORTER; trial links from ClinicalTrials.gov; estimates, votes and beliefs from the OpenQuestion graph.