AIMC Topic: Antiviral Agents

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Identification of Risk Factors and Symptoms of COVID-19: Analysis of Biomedical Literature and Social Media Data.

Journal of medical Internet research Oct 2, 2020
BACKGROUND: In December 2019, the COVID-19 outbreak started in China and rapidly spread around the world. Lack of a vaccine or optimized intervention raised the importance of characterizing risk factors and symptoms for the early identification and s...
Disease Outbreaks Diarrhea Antiviral Agents Social Media Cough Pandemics COVID-19 Retrospective Studies SARS-CoV-2 Risk Factors Dyspnea Fatigue Oxygen Inhalation Therapy Myalgia Betacoronavirus Pneumonia, Viral Publications Fever Headache Coronavirus Infections Data Collection Humans Machine Learning
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Evolutionary artificial intelligence based peptide discoveries for effective Covid-19 therapeutics.

Biochimica et biophysica acta. Molecular basis of disease Sep 24, 2020
An epidemic caused by COVID-19 in China turned into pandemic within a short duration affecting countries worldwide. Researchers and companies around the world are working on all the possible strategies to develop a curative or preventive strategy for...
COVID-19 Drug Treatment Virus Replication Humans Artificial Intelligence COVID-19 SARS-CoV-2 Viral Vaccines Peptides Antiviral Agents Peptide Library Antibodies, Viral Molecular Dynamics Simulation
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Artificial intelligence in COVID-19 drug repurposing.

The Lancet. Digital health Sep 18, 2020
Drug repurposing or repositioning is a technique whereby existing drugs are used to treat emerging and challenging diseases, including COVID-19. Drug repurposing has become a promising approach because of the opportunity for reduced development timel...
Antiviral Agents Treatment Outcome Drug Repositioning COVID-19 Drug Treatment Humans Drug Therapy, Combination Artificial Intelligence Algorithms SARS-CoV-2 Drug Discovery
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PeptiDesCalculator: Software for computation of peptide descriptors. Definition, implementation and case studies for 9 bioactivity endpoints.

Proteins Sep 17, 2020
We present a novel Java-based program denominated PeptiDesCalculator for computing peptide descriptors. These descriptors include: redefinitions of known protein parameters to suite the peptide domain, generalization schemes for the global descriptio...
Anti-Bacterial Agents Neoplasms Peptides Antineoplastic Agents HIV Infections Humans Neural Networks, Computer Software Pseudomonas aeruginosa Hepatitis C Protein Stability Peptide Mapping Antiviral Agents Support Vector Machine Candida albicans Antifungal Agents Listeria monocytogenes
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A new advanced in silico drug discovery method for novel coronavirus (SARS-CoV-2) with tensor decomposition-based unsupervised feature extraction.

PloS one Sep 11, 2020
BACKGROUND: COVID-19 is a critical pandemic that has affected human communities worldwide, and there is an urgent need to develop effective drugs. Although there are a large number of candidate drug compounds that may be useful for treating COVID-19,...
A549 Cells Humans Betacoronavirus SARS-CoV-2 Drug Discovery Antiviral Agents Unsupervised Machine Learning
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Drug Design of Targeted Chemical Libraries Based on Artificial Intelligence and Pair-Based Multiobjective Optimization.

Journal of chemical information and modeling Sep 9, 2020
Artificial intelligence and multiobjective optimization represent promising solutions to bridge chemical and biological landscapes by addressing the automated design of compounds as a result of a humanlike creative process. In the present study, we ...
Humans Neural Networks, Computer Acetylcholinesterase Cholinesterase Inhibitors Enzyme Inhibitors Viral Nonstructural Proteins Small Molecule Libraries Coronavirus 3C Proteases Cysteine Endopeptidases Betacoronavirus Pneumonia, Viral Drug Design Artificial Intelligence Influenza A virus Pandemics Antiviral Agents COVID-19 Coronavirus Infections SARS-CoV-2 Neuraminidase Molecular Docking Simulation
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Screening of Therapeutic Agents for COVID-19 Using Machine Learning and Ensemble Docking Studies.

The journal of physical chemistry letters Aug 14, 2020
The current pandemic demands a search for therapeutic agents against the novel coronavirus SARS-CoV-2. Here, we present an efficient computational strategy that combines machine learning (ML)-based models and high-fidelity ensemble docking studies to...
Humans Machine Learning SARS-CoV-2 Molecular Docking Simulation Protein Conformation Antiviral Agents Hydrogen Bonding Spike Glycoprotein, Coronavirus Betacoronavirus Drug Evaluation, Preclinical
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Repurpose Open Data to Discover Therapeutics for COVID-19 Using Deep Learning.

Journal of proteome research Jul 24, 2020
There have been more than 2.2 million confirmed cases and over 120 000 deaths from the human coronavirus disease 2019 (COVID-19) pandemic, caused by the novel severe acute respiratory syndrome coronavirus (SARS-CoV-2), in the United States alone. How...
Antiviral Agents Proteome Drug Repositioning Coronavirus Infections Betacoronavirus Pandemics Humans COVID-19 SARS-CoV-2 Transcriptome Deep Learning Pneumonia, Viral
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Mechanism of baricitinib supports artificial intelligence-predicted testing in COVID-19 patients.

EMBO molecular medicine Jun 24, 2020
Baricitinib is an oral Janus kinase (JAK)1/JAK2 inhibitor approved for the treatment of rheumatoid arthritis (RA) that was independently predicted, using artificial intelligence (AI) algorithms, to be useful for COVID-19 infection via proposed anti-c...
COVID-19 Drug Treatment Pyrazoles Protein Kinase Inhibitors Purines Spheroids, Cellular Intracellular Signaling Peptides and Proteins Betacoronavirus Pneumonia, Viral Azetidines Drug Repositioning Leukocytes Sulfonamides Drug Evaluation, Preclinical COVID-19 Coronavirus Infections Cytokines Male Female Middle Aged SARS-CoV-2 Antiviral Agents Aged Liver Adult Humans Protein Serine-Threonine Kinases Artificial Intelligence Pandemics
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Deep Learning Based Drug Screening for Novel Coronavirus 2019-nCov.

Interdisciplinary sciences, computational life sciences Jun 1, 2020
A novel coronavirus, called 2019-nCoV, was recently found in Wuhan, Hubei Province of China, and now is spreading across China and other parts of the world. Although there are some drugs to treat 2019-nCoV, there is no proper scientific evidence abou...
SARS-CoV-2 Sequence Alignment Humans Drug Design Cysteine Endopeptidases Ligands Models, Molecular Pandemics Deep Learning Databases, Pharmaceutical Catalytic Domain User-Computer Interface Pneumonia, Viral Molecular Dynamics Simulation Oligopeptides COVID-19 Coronavirus 3C Proteases Viral Nonstructural Proteins Databases, Nucleic Acid Drug Evaluation, Preclinical Amino Acid Sequence Coronavirus Infections Antiviral Agents Structural Homology, Protein Betacoronavirus
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