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10 results in Authors: Vinicius Alves

COVID-19 Knowledge Extractor (COKE): A Tool and a Web Portal to Extract Drug - Target Protein Associations from the CORD-19 Corpus of Scientific Publications on COVID-19

Daniel Korn, Vera Pervitsky, Tesia Bobrowski, Vinicius Alves, Charles Schmitt, Cristopher Bizon, Nancy Baker, Rada Chirkova, Artem Cherkasov, Eugene Muratov, Alexander Tropsha

Version 1 posted 26 November 2020

661

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Citations

Biological and Medicinal Chemistry

Working Paper

Novel Pharmacokinetics Profiler (PhaKinPro): Model Development, Validation, and Implementation as a Web-Tool for Triaging Compounds with Undesired PK Profiles

Marielle Rath, James Wellnitz, Holli-Joi Martin, Cleber Melo-Filho, Joshua Hochuli, Guilherme Martins da Silva, Jon-Michael Beasley, Travis Maxfield, Zoe Sessions, Konstantin Popov, Alexey Zakharov, Artem Cherkasov, Vinicius Alves, Eugene Muratov, Alexander Tropsha

Version 1 posted 20 March 2023

866

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Theoretical and Computational Chemistry

Working Paper

Automated Framework for Developing Predictive Machine Learning Models for Data-Driven Drug Discovery

Bruno J. Neves, José T. Moreira-Filho, Arthur C. Silva, Joyce V. V. B. Borba, Melina Mottin, Vinicius Alves, Rodolpho C. Braga, Eugene Muratov, Carolina Andrade

Version 1 posted 07 May 2020

795

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Citations

Biological and Medicinal Chemistry

Working Paper

Discovery of Potential GSK-3β Allosteric Modulators for Alzheimer’s Disease

Guilherme Martins Silva, Vinicius Medeiros Alves, Suzane Quintana Gomes, Joshua Earl Hochuli, Eugene Muratov, Alexander Tropsha, Carlos Henrique Tomich Paula Silva

Version 1 posted 23 March 2023

309

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Agriculture and Food Chemistry

Working Paper

Novel Classification of Mono-Molecular Odorants using Standardized Semantic Profiles

Andrew Thieme, Daniel Korn, Vinicius Alves, Eugene Muratov, Alexander Tropsha

Version 1 posted 24 January 2022

381

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Citations

Theoretical and Computational Chemistry

Working Paper

Lies and Liabilities: Computational Assessment of High-Throughput Screening Hits to Identify Artifact Compounds.

Vinicius Alves, Adam Yasgar, James Wellnitz, Ganesha Bantukallu, Marielle Rath, Rodolpho Braga, Stephen Capuzzi, Anton Simeonov, Eugene Muratov, Alexey Zakharov, Alexander Tropsha

Version 1 posted 22 February 2023

409

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Theoretical and Computational Chemistry

Working Paper

PreSS/MD: Predictor of Skin Sensitization Caused by Chemicals Leaching from Medical Devices

Joyce Borba, Vinicius Alves, Rodolpho Braga, Daniel Korn, Nicole Kleinstreuer, Kevin Causey, Alexander Tropsha, Diego Rua, Eugene Muratov

Version 1 posted 03 January 2022

310

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Theoretical and Computational Chemistry

Working Paper

STopTox: An In-Silico Alternative to Animal Testing for Acute Systemic and TOPical TOXicity

Joyce V. V. B. Borba, Vinicius Alves, Rodolpho Braga, Daniel Korn, Kirsten Overdahl, Arthur C. Silva, Steven Hall, Erik Overdahl, Judy Strickland, DAvid Allen, Nicole Kleinstreuer, Carolina Andrade, Eugene Muratov, Alexander Tropsha

Version 1 posted 25 November 2020

911

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Citations

Biological and Medicinal Chemistry

Working Paper

The Brazilian Compound Library (BraCoLi) Database: A Brazilian Repository of Chemical and Biological Information for Drug Design

Gabriel Corrêa Veríssimo, Valtair Severino dos Santos Junior, Ingrid Ariela do Rosário de Almeida, Marina Sant'Anna Mitraud Ruas, Lukas Galuppo Coutinho, Renata Barbosa de Oliveira, Vinicius Gonçalves Maltarollo, Ricardo José Alves

Version 2 posted 16 July 2021

582

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Theoretical and Computational Chemistry

Working Paper

Computational Models Identify Several FDA Approved or Experimental Drugs as Putative Agents Against SARS-CoV-2

Tesia Bobrowski, Vinicius Alves, Cleber C. Melo-Filho, Daniel Korn, Scott S. Auerbach, Charles Schmitt, Eugene Muratov, Alexander Tropsha

Version 1 posted 22 April 2020

1,530

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10 results in Vinicius Alves in Authors: Vinicius Alves

COVID-19 Knowledge Extractor (COKE): A Tool and a Web Portal to Extract Drug - Target Protein Associations from the CORD-19 Corpus of Scientific Publications on COVID-19

Novel Pharmacokinetics Profiler (PhaKinPro): Model Development, Validation, and Implementation as a Web-Tool for Triaging Compounds with Undesired PK Profiles

Automated Framework for Developing Predictive Machine Learning Models for Data-Driven Drug Discovery

Discovery of Potential GSK-3β Allosteric Modulators for Alzheimer’s Disease

Novel Classification of Mono-Molecular Odorants using Standardized Semantic Profiles

Lies and Liabilities: Computational Assessment of High-Throughput Screening Hits to Identify Artifact Compounds.

PreSS/MD: Predictor of Skin Sensitization Caused by Chemicals Leaching from Medical Devices

STopTox: An In-Silico Alternative to Animal Testing for Acute Systemic and TOPical TOXicity

The Brazilian Compound Library (BraCoLi) Database: A Brazilian Repository of Chemical and Biological Information for Drug Design

Computational Models Identify Several FDA Approved or Experimental Drugs as Putative Agents Against SARS-CoV-2

10 results in Authors: Vinicius Alves