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CLC-Pred: A freely available web-service for in silico prediction of human cell line cytotoxicity for drug-like compounds

PloS one, 2018-01, Vol.13 (1), p.e0191838-e0191838

2018

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QSAR without borders

Chemical Society reviews, 2020-06, Vol.49 (11), p.3525-3564

2020

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Identification of Molecular Mechanisms Involved in Viral Infection Progression Based on Text Mining: Case Study for HIV Infection

International journal of molecular sciences, 2023-01, Vol.24 (2), p.1465

2023

Volltextzugriff (PDF)

Machine Learning in Discovery of New Antivirals and Optimization of Viral Infections Therapy

Current medicinal chemistry, 2021-01, Vol.28 (38), p.7840

2021

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Pharmacological profile of natural and synthetic compounds with rigid adamantane-based scaffolds as potential agents for the treatment of neurodegenerative diseases

Biochemical and biophysical research communications, 2020-09, Vol.529 (4), p.1225-1241

2020

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HGMMX: Host Gut Microbiota Metabolism Xenobiotics Database

Journal of chemical information and modeling, 2023-11, Vol.63 (21), p.6463-6468

2023

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SOMP: web server for in silico prediction of sites of metabolism for drug-like compounds

Bioinformatics (Oxford, England), 2015-06, Vol.31 (12), p.2046-2048

2015

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Molecular Docking Studies of HIV-1 Resistance to Reverse Transcriptase Inhibitors: Mini-Review

Molecules (Basel, Switzerland), 2018-05, Vol.23 (5), p.1233

2018

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Antitumor Profile of Carbon-Bridged Steroids (CBS) and Triterpenoids

Marine drugs, 2021-06, Vol.19 (6), p.324

2021

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Transcriptome-based analysis of human peripheral blood reveals regulators of immune response in different viral infections

Frontiers in immunology, 2023-09, Vol.14, p.1199482-1199482

2023

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Antiprotozoal and Antitumor Activity of Natural Polycyclic Endoperoxides: Origin, Structures and Biological Activity

Molecules (Basel, Switzerland), 2021-01, Vol.26 (3), p.686

2021

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New Positive TRPC6 Modulator Penetrates Blood–Brain Barrier, Eliminates Synaptic Deficiency and Restores Memory Deficit in 5xFAD Mice

International journal of molecular sciences, 2022-11, Vol.23 (21), p.13552

2022

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Ameliorative effect of Curcumin on seizure severity, depression like behavior, learning and memory deficit in post-pentylenetetrazole-kindled mice

European journal of pharmacology, 2013-03, Vol.704 (1-3), p.33-40

2013

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A Computational Approach for the Prediction of HIV Resistance Based on Amino Acid and Nucleotide Descriptors

Molecules (Basel, Switzerland), 2018-10, Vol.23 (11), p.2751

2018

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Chemical Diversity of Soft Coral Steroids and Their Pharmacological Activities

Marine drugs, 2020-12, Vol.18 (12), p.613

2020

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Computer-Aided Estimation of Biological Activity Profiles of Drug-Like Compounds Taking into Account Their Metabolism in Human Body

International journal of molecular sciences, 2020-10, Vol.21 (20), p.7492

2020

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Computational Prediction of Inhibitors and Inducers of the Major Isoforms of Cytochrome P450

Molecules (Basel, Switzerland), 2022-09, Vol.27 (18), p.5875

2022

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In silico assessment of adverse drug reactions and associated mechanisms

Drug discovery today, 2016-01, Vol.21 (1), p.58-71

2016

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Assessment of the cardiovascular adverse effects of drug-drug interactions through a combined analysis of spontaneous reports and predicted drug-target interactions

PLoS computational biology, 2019-07, Vol.15 (7), p.e1006851

2019

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Multi-targeted natural products evaluation based on biological activity prediction with PASS

Current pharmaceutical design, 2010-05, Vol.16 (15), p.1703

2010

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Highly oxygenated isoprenoid lipids derived from fungi and fungal endophytes: Origin and biological activities

Steroids, 2018-12, Vol.140, p.114-124

2018

Volltextzugriff (PDF)

CLC-Pred 2.0: A Freely Available Web Application for In Silico Prediction of Human Cell Line Cytotoxicity and Molecular Mechanisms of Action for Druglike Compounds

International journal of molecular sciences, 2023-01, Vol.24 (2), p.1689

2023

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Naturally occurring aromatic steroids and their biological activities

Applied microbiology and biotechnology, 2018-06, Vol.102 (11), p.4663-4674

2018

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Naturally occurring plant isoquinoline N-oxide alkaloids: Their pharmacological and SAR activities

Phytomedicine (Stuttgart), 2015-01, Vol.22 (1), p.183-202

2015

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Relationships between the Structure and Severe Drug-Induced Liver Injury for Low, Medium, and High Doses of Drugs

Chemical research in toxicology, 2022-03, Vol.35 (3), p.402-411

2022

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CLC-Pred: A freely available web-service for in silico prediction of human cell line cytotoxicity for drug-like compounds

QSAR without borders

Identification of Molecular Mechanisms Involved in Viral Infection Progression Based on Text Mining: Case Study for HIV Infection

Machine Learning in Discovery of New Antivirals and Optimization of Viral Infections Therapy

Pharmacological profile of natural and synthetic compounds with rigid adamantane-based scaffolds as potential agents for the treatment of neurodegenerative diseases

HGMMX: Host Gut Microbiota Metabolism Xenobiotics Database

SOMP: web server for in silico prediction of sites of metabolism for drug-like compounds

Molecular Docking Studies of HIV-1 Resistance to Reverse Transcriptase Inhibitors: Mini-Review

Antitumor Profile of Carbon-Bridged Steroids (CBS) and Triterpenoids

Transcriptome-based analysis of human peripheral blood reveals regulators of immune response in different viral infections

Antiprotozoal and Antitumor Activity of Natural Polycyclic Endoperoxides: Origin, Structures and Biological Activity

New Positive TRPC6 Modulator Penetrates Blood–Brain Barrier, Eliminates Synaptic Deficiency and Restores Memory Deficit in 5xFAD Mice

Ameliorative effect of Curcumin on seizure severity, depression like behavior, learning and memory deficit in post-pentylenetetrazole-kindled mice

A Computational Approach for the Prediction of HIV Resistance Based on Amino Acid and Nucleotide Descriptors

Chemical Diversity of Soft Coral Steroids and Their Pharmacological Activities

Computer-Aided Estimation of Biological Activity Profiles of Drug-Like Compounds Taking into Account Their Metabolism in Human Body

Computational Prediction of Inhibitors and Inducers of the Major Isoforms of Cytochrome P450

In silico assessment of adverse drug reactions and associated mechanisms

Assessment of the cardiovascular adverse effects of drug-drug interactions through a combined analysis of spontaneous reports and predicted drug-target interactions

Multi-targeted natural products evaluation based on biological activity prediction with PASS

Highly oxygenated isoprenoid lipids derived from fungi and fungal endophytes: Origin and biological activities

CLC-Pred 2.0: A Freely Available Web Application for In Silico Prediction of Human Cell Line Cytotoxicity and Molecular Mechanisms of Action for Druglike Compounds

Naturally occurring aromatic steroids and their biological activities

Naturally occurring plant isoquinoline N-oxide alkaloids: Their pharmacological and SAR activities

Relationships between the Structure and Severe Drug-Induced Liver Injury for Low, Medium, and High Doses of Drugs

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