Zobrazeno 1 - 10
of 42
pro vyhledávání: '"Marcos A Villarreal"'
Publikováno v:
PLoS ONE, Vol 14, Iss 6, p e0218042 (2019)
γ-Aminobutyric acid (GABA) is the major inhibitory neurotransmitter in the vertebrate and invertebrate nervous system. GABAA receptors are activated by GABA and their agonists, and modulated by a wide variety of recognized drugs, including barbitura
Externí odkaz:
https://doaj.org/article/8a68e37fcc20428d80f0317c4736dbd9
Publikováno v:
PLoS ONE, Vol 13, Iss 3, p e0194154 (2018)
The fatty acid-binding proteins L-BABP and Rep1-NCXSQ bind to anionic lipid membranes by electrostatic interactions. According to Molecular Dynamics (MD) simulations, the interaction of the protein macrodipole with the membrane electric field is a dr
Externí odkaz:
https://doaj.org/article/980a250e0af240ab876075262496c2de
Vinardo: A Scoring Function Based on Autodock Vina Improves Scoring, Docking, and Virtual Screening.
Autor:
Rodrigo Quiroga, Marcos A Villarreal
Publikováno v:
PLoS ONE, Vol 11, Iss 5, p e0155183 (2016)
Autodock Vina is a very popular, and highly cited, open source docking program. Here we present a scoring function which we call Vinardo (Vina RaDii Optimized). Vinardo is based on Vina, and was trained through a novel approach, on state of the art d
Externí odkaz:
https://doaj.org/article/8a6ec845e41a4b3e8261345e52076a02
Autor:
Virginia Miguel, Elisa M E Correa, Luisina De Tullio, José L Barra, Carlos E Argaraña, Marcos A Villarreal
Publikováno v:
PLoS ONE, Vol 8, Iss 7, p e69907 (2013)
Mismatch Repair System corrects mutations arising from DNA replication that escape from DNA polymerase proofreading activity. This system consists of three main proteins, MutS-L-H, responsible for lesion recognition and repair. MutL is a member of GH
Externí odkaz:
https://doaj.org/article/f8b1516803034a198e53f25929971d01
Publikováno v:
ACS Omega
ACS Omega, Vol 7, Iss 2, Pp 1988-2001 (2022)
ACS Omega, Vol 7, Iss 2, Pp 1988-2001 (2022)
The RDL receptor is one of the most relevant protein targets for insecticide molecules. It belongs to the pentameric ligand-gated ion channel (pLGIC) family. Given that the experimental structures of pLGICs are difficult to obtain, homology modeling
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::ec240d1d6e4ec2e946aad7b903535a8d
https://doi.org/10.1021/acsomega.1c05465
https://doi.org/10.1021/acsomega.1c05465
Autor:
Walter Filgueira de Azevedo Junior, Gabriela Bitencourt-Ferreira, Marcos A. Villarreal, Rodrigo Quiroga, Nadezhda Biziukova, Vladimir Poroikov, Olga Tarasova
Publikováno v:
Current Medicinal Chemistry. 30
Background: The idea of scoring function space established a systems-level approach to address the development of models to predict the affinity of drug molecules by those interested in drug discovery. Objective: Our goal here is to review the concep
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::1be6589f04852efcc96cf1ef1eb1020d
https://doi.org/10.2174/0929867330666230321103731
https://doi.org/10.2174/0929867330666230321103731
Publikováno v:
Journal of Computer-Aided Molecular Design
CONICET Digital (CONICET)
Consejo Nacional de Investigaciones Científicas y Técnicas
instacron:CONICET
CONICET Digital (CONICET)
Consejo Nacional de Investigaciones Científicas y Técnicas
instacron:CONICET
Screening already approved drugs for activity against a novel pathogen can be an important part of global rapid-response strategies in pandemics. Such high-throughput repurposing screens have already identifed several existing drugs with potential to
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::63be36ad62e05b9851bfadacb059804b
https://doi.org/10.1007/s10822-021-00432-3
https://doi.org/10.1007/s10822-021-00432-3
Publikováno v:
The Journal of Physical Chemistry C. 124:24009-24016
The coalescence of two nanoparticles is a fundamental process that plays a dominant role in the formation of new nanoparticles. It constitutes a direct way to synthesize bimetallic nanoparticles wi...
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::868b8544950feb6ee1546e4b2d556b85
https://doi.org/10.1021/acs.jpcc.0c07619
https://doi.org/10.1021/acs.jpcc.0c07619
Publikováno v:
Journal of the Endocrine Society
Background: Clinical manifestations of Nonclassic CAH (NCCAH) in women may range from asymptomatic to hirsutism, oligo-menorrhea, or infertility. Testicular adrenal rest tumors are common in men with classic CAH though uncommon in NCCAH. In women wit
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::8cd711e294c4348f4d67820c51bcc6aa
https://doi.org/10.1210/jendso/bvab048.322
https://doi.org/10.1210/jendso/bvab048.322
Publikováno v:
Rehabilitation nursing : the official journal of the Association of Rehabilitation Nurses. 44(1)
PURPOSE The aim of the study was to determine if listening to music may reduce anxiety experienced by stroke patients during acute rehabilitation. DESIGN A prospective, nonblinded, randomized study in an inpatient rehabilitation setting. METHODS Fift
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::4c71dfdb12b2c363831bb4b8a48711bb
https://pubmed.ncbi.nlm.nih.gov/30601431
https://pubmed.ncbi.nlm.nih.gov/30601431