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GTransCYPs: an improved graph transformer neural network with attention pooling for reliably predicting CYP450 inhibitors.
- Published in:
- Journal of Cheminformatics, 2024, v. 16, n. 1, p. 1, doi. 10.1186/s13321-024-00915-z
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- Article
Antidiabetic Phytoconstituents: From Traditional Medicine to Modern Drug Discovery.
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- Pharmacognosy Magazine, 2024, v. 20, n. 4, p. 1048, doi. 10.1177/09731296241247606
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- Article
BASE: a web service for providing compound-protein binding affinity prediction datasets with reduced similarity bias.
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- BMC Bioinformatics, 2024, v. 25, n. 1, p. 1, doi. 10.1186/s12859-024-05968-3
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- Article
TamGen: drug design with target-aware molecule generation through a chemical language model.
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- Nature Communications, 2024, v. 15, n. 1, p. 1, doi. 10.1038/s41467-024-53632-4
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- Publication type:
- Article
TARGETING MACROPHAGE MIGRATION INHIBITORY FACTOR (MIF): SMALL-MOLECULE INHIBITORS AND THERAPEUTIC STRATEGIES FOR IMMUNE DISORDERS AND CANCER.
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- Gomal Journal of Medical Sciences, 2024, v. 22, n. 3, p. 286, doi. 10.46903/gjms/22.03.1441
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- Article
A comprehensive comparison of deep learning-based compound-target interaction prediction models to unveil guiding design principles.
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- Journal of Cheminformatics, 2024, v. 16, n. 1, p. 1, doi. 10.1186/s13321-024-00913-1
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- Publication type:
- Article
Bridging chemical structure and conceptual knowledge enables accurate prediction of compound-protein interaction.
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- BMC Biology, 2024, v. 22, n. 1, p. 1, doi. 10.1186/s12915-024-02049-y
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- Article
Hydrogel-Based Vascularized Organ Tissue Engineering: A Systematized Review on Abdominal Organs.
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- Gels (2310-2861), 2024, v. 10, n. 10, p. 653, doi. 10.3390/gels10100653
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- Article
The potential of muscarinic M<sub>1</sub> and M<sub>4</sub> receptor activators for the treatment of cognitive impairment associated with schizophrenia.
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- Frontiers in Psychiatry, 2024, p. 1, doi. 10.3389/fpsyt.2024.1421554
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- Article
Innovations in Microfluidics to Enable Novel Biomedical Applications.
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- Biosensors (2079-6374), 2024, v. 14, n. 10, p. 507, doi. 10.3390/bios14100507
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- Article
A review on recent theoretical approaches made in the discovery of potential Covid-19 therapeutics.
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- Journal of Mathematical Chemistry, 2024, v. 62, n. 10, p. 2924, doi. 10.1007/s10910-024-01626-4
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- Article
Accurate protein-ligand binding free energy estimation using QM/MM on multi-conformers predicted from classical mining minima.
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- Communications Chemistry, 2024, v. 7, n. 1, p. 1, doi. 10.1038/s42004-024-01328-7
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- Article
Exploring the Artificial Intelligence and Its Impact in Pharmaceutical Sciences: Insights Toward the Horizons Where Technology Meets Tradition.
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- Chemical Biology & Drug Design, 2024, v. 104, n. 4, p. 1, doi. 10.1111/cbdd.14639
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- Article
Anticancer potential of decursin, decursinol angelate, and decursinol from Angelica gigas Nakai: A comprehensive review and future therapeutic prospects.
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- Food Science & Nutrition, 2024, v. 12, n. 10, p. 6970, doi. 10.1002/fsn3.4376
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- Article
The Promise of Artificial Intelligence in Reshaping Anticancer Drug Development.
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- Cells (2073-4409), 2024, v. 13, n. 20, p. 1709, doi. 10.3390/cells13201709
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- Article
A novel 4-aminoquinoline chemotype with multistage antimalarial activity and lack of cross-resistance with PfCRT and PfMDR1 mutants.
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- PLoS Pathogens, 2024, v. 20, n. 10, p. 1, doi. 10.1371/journal.ppat.1012627
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- Article
Dirichlet latent modelling enables effective learning and sampling of the functional protein design space.
- Published in:
- Nature Communications, 2024, v. 15, n. 1, p. 1, doi. 10.1038/s41467-024-53622-6
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- Publication type:
- Article
Fusing Artificial Intelligence and Machine Learning for Anti-Cancer Drug Discovery.
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- 2024
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- Publication type:
- Editorial
RNA Binding Proteins as Potential Therapeutic Targets in Colorectal Cancer.
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- Cancers, 2024, v. 16, n. 20, p. 3502, doi. 10.3390/cancers16203502
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- Article
Bioassay‐guided separation and identification of the anticancer composition from Curcuma longa L. by the combination strategy of methanol gradient countercurrent chromatography and ultra‐high‐performance liquid chromatography coupled with high‐resolution mass spectrometry
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- Journal of Separation Science, 2022, v. 45, n. 24, p. 4478, doi. 10.1002/jssc.202200348
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- Article
Advances in glycopeptide enrichment methods for the analysis of protein glycosylation over the past decade.
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- Journal of Separation Science, 2022, v. 45, n. 16, p. 3169, doi. 10.1002/jssc.202200292
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- Article
Screening the bioactive compound from Coptis chinensis inflorescence by immobilized peroxisome proliferator‐activated receptor‐gamma.
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- Journal of Separation Science, 2022, v. 45, n. 15, p. 2855, doi. 10.1002/jssc.202101014
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- Article
Stem cells and common biomaterials in dentistry: a review study.
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- Journal of Materials Science: Materials in Medicine, 2022, v. 33, n. 7, p. 1, doi. 10.1007/s10856-022-06676-1
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- Article
Radiolabeled HOCPCA as a highly useful tool in drug discovery and pharmacology.
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- Journal of Labelled Compounds & Radiopharmaceuticals, 2021, v. 64, n. 2, p. 77, doi. 10.1002/jlcr.3870
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- Article
The magic of small structure differences in a sodium‐glucose cotransporter drug discovery project—<sup>14</sup>C‐labelled drug candidates in a key‐differentiating study.
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- Journal of Labelled Compounds & Radiopharmaceuticals, 2021, v. 64, n. 2, p. 73, doi. 10.1002/jlcr.3869
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- Publication type:
- Article
Target‐based virtual screening, computational multiscoring docking and molecular dynamics simulation of small molecules as promising drug candidate affecting kinesin‐like protein KIFC1.
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- Cell Biochemistry & Function, 2022, v. 40, n. 5, p. 451, doi. 10.1002/cbf.3707
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- Article
Anticancer acumens of three Annona species: a proportional review.
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- Journal of Cancer Research & Clinical Oncology, 2023, v. 149, n. 9, p. 6693, doi. 10.1007/s00432-022-04306-5
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- Publication type:
- Article
Role of smartphone devices in precision oncology.
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- Journal of Cancer Research & Clinical Oncology, 2023, v. 149, n. 1, p. 393, doi. 10.1007/s00432-022-04413-3
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- Publication type:
- Article
DRUG REPURPOSING: AN EMERGING APPROACH TO DRUG DISCOVERY.
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- i-Manager's Journal on Chemical Sciences (JCHEM), 2024, v. 4, n. 1, p. 24, doi. 10.26634/jchem.4.1.21137
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- Article
application of natural compounds in uveal melanoma drug discovery.
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- Journal of Pharmacy & Pharmacology, 2022, v. 74, n. 5, p. 660, doi. 10.1093/jpp/rgac009
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- Article
Developing Peripheral Biochemical Biomarkers of Brain Disorders: Insights from Zebrafish Models.
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- Biochemistry (00062979), 2024, v. 89, n. 2, p. 377, doi. 10.1134/S0006297924020160
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- Article
Curative Potential of High-Value Phytochemicals on COVID-19 Infection.
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- Biochemistry (00062979), 2023, v. 88, n. 1, p. 64, doi. 10.1134/S0006297923010066
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- Article
Repurposing bempedoic acid as a histone deacetylase 6 inhibitor.
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- International Journal of Epigenetics, 2023, v. 3, n. 1, p. N.PAG, doi. 10.3892/ije.2023.15
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- Article
Medicines—Aims and Scope Updates.
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- Medicines, 2024, v. 11, n. 5, p. 11, doi. 10.3390/medicines11050011
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- Article
Phytochemical and Pharmacological Investigations of Different Extracts of Dracaena spicata Roxb. Available in Bangladesh.
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- Tropical Journal of Natural Product Research, 2024, v. 8, n. 6, p. 7339, doi. 10.26538/tjnpr/v8i6.1
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- Article
In silico Evaluation of the Inhibitory Potential of Cymbopogonol from Cymbopogon citratus Towards Falcipain-2 (FP2) Cysteine Protease of Plasmodium falciparum.
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- Tropical Journal of Natural Product Research, 2022, v. 6, n. 10, p. 1687, doi. 10.26538/tjnpr/v6i10.22
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- Article
Knowledge mapping of Nigeria's scientific contribution to antimicrobial resistance research: A visualized investigation using VOS viewer and cite space.
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- Microbes & Infectious Diseases, 2024, v. 5, n. 2, p. 584, doi. 10.21608/MID.2022.165940.1391
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- Article
A brief review on the lessons learned from COVID-19 on drug discovery and research.
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- Medicine & Pharmacy Reports: Clujul Medical, 2024, v. 97, n. 3, p. 243, doi. 10.15386/mpr-2641
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- Article
Deep learning approaches for natural product discovery from plant endophytic microbiomes.
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- Environmental Microbiome, 2021, v. 16, n. 1, p. 1, doi. 10.1186/s40793-021-00375-0
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- Article
An Overview of Traditional Medicinal Plants Used in Treating Hepatocellular Carcinoma (HCC) with Emphasis on Mechanisms of Action.
- Published in:
- Journal of Tropical Life Science, 2024, v. 14, n. 2, p. 405, doi. 10.11594/jtls.14.02.20
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- Publication type:
- Article
The Cytotoxic Activity of Marine Sponge-Derived Fungus Aspergillus nomius NC06 Against HT29 Colon Cancer Cells.
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- Journal of Tropical Life Science, 2024, v. 14, n. 1, p. 39, doi. 10.11594/jtls.14.01.05
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- Article
Multifaceted mitochondrial as a novel therapeutic target in dry eye: insights and interventions.
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- Cell Death Discovery, 2024, v. 10, n. 1, p. 1, doi. 10.1038/s41420-024-02159-0
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- Publication type:
- Article
Influence Of Heterocyclic Compounds In The Identification Of Novel Molecules In Drug Discovery To Achieve Diversified Biological Activities - A Review.
- Published in:
- International Journal of Pharmaceutical Research (09752366), 2021, v. 13, n. 1, p. 6502, doi. 10.31838/ijpr/2021.13.01.829
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- Article
Repurposing of Drugs: Progress, development approaches and challenges.
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- International Journal of Pharmaceutical Research (09752366), 2021, v. 13, n. 1, p. 3710, doi. 10.31838/ijpr/2021.13.01.529
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- Article
Ethnopharmacology and drug development.
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- International Journal of Pharmaceutical Research (09752366), 2020, v. 12, n. 4, p. 85, doi. 10.31838/ijpr/2020.12.04.018
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- Article
WELLINGTON.
- Published in:
- Chemistry in New Zealand (Christchurch), 2022, v. 86, n. 3, p. 99
- Publication type:
- Article
OTAGO.
- Published in:
- Chemistry in New Zealand (Christchurch), 2022, v. 86, n. 3, p. 98
- Publication type:
- Article
Stability of Immobilized Chemosensor‐Filled Vesicles on Anti‐Fouling Polymer Brush Surfaces.
- Published in:
- Advanced Materials Interfaces, 2024, v. 11, n. 21, p. 1, doi. 10.1002/admi.202400200
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- Article
Computational Profiling of Potential Endophyte Metabolites against Tobacco Mosaic Virus: A Strategy for Antiviral Drug Discovery.
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- Mysore Journal of Agricultural Sciences, 2024, v. 59, n. 2, p. 274
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- Publication type:
- Article
Multimodal Transformers and Their Applications in Drug Target Discovery for Aging and Age-Related Diseases.
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- Journals of Gerontology Series A: Biological Sciences & Medical Sciences, 2024, v. 79, n. 9, p. 1, doi. 10.1093/gerona/glae006
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- Publication type:
- Article