Network pharmacology, a promising approach to reveal the pharmacology mechanism of Chinese medicine formula
L Zhao, H Zhang, N Li, J Chen, H Xu, Y Wang… - Journal of …, 2023 - Elsevier
Ethnopharmacological relevance Network pharmacology is a new discipline based on
systems biology theory, biological system network analysis, and multi-target drug molecule …
systems biology theory, biological system network analysis, and multi-target drug molecule …
[HTML][HTML] Artificial intelligence to deep learning: machine intelligence approach for drug discovery
Drug designing and development is an important area of research for pharmaceutical
companies and chemical scientists. However, low efficacy, off-target delivery, time …
companies and chemical scientists. However, low efficacy, off-target delivery, time …
ADMETlab 2.0: an integrated online platform for accurate and comprehensive predictions of ADMET properties
Because undesirable pharmacokinetics and toxicity of candidate compounds are the main
reasons for the failure of drug development, it has been widely recognized that absorption …
reasons for the failure of drug development, it has been widely recognized that absorption …
In silico methods and tools for drug discovery
In the past, conventional drug discovery strategies have been successfully employed to
develop new drugs, but the process from lead identification to clinical trials takes more than …
develop new drugs, but the process from lead identification to clinical trials takes more than …
Discovery of a structural class of antibiotics with explainable deep learning
The discovery of novel structural classes of antibiotics is urgently needed to address the
ongoing antibiotic resistance crisis,,,,,,,–. Deep learning approaches have aided in exploring …
ongoing antibiotic resistance crisis,,,,,,,–. Deep learning approaches have aided in exploring …
Discovery of sulfadrug–pyrrole conjugates as carbonic anhydrase and acetylcholinesterase inhibitors
Human carbonic anhydrase (hCA) isoenzymes are zinc ion‐containing, widespread
metalloenzymes and they classically play a role in pH homeostasis maintenance. CA …
metalloenzymes and they classically play a role in pH homeostasis maintenance. CA …
[HTML][HTML] Blockchain and artificial intelligence technology in e-Health
P Tagde, S Tagde, T Bhattacharya, P Tagde… - … Science and Pollution …, 2021 - Springer
Blockchain and artificial intelligence technologies are novel innovations in healthcare
sector. Data on healthcare indices are collected from data published on Web of Sciences …
sector. Data on healthcare indices are collected from data published on Web of Sciences …
SwissTargetPrediction: updated data and new features for efficient prediction of protein targets of small molecules
A Daina, O Michielin, V Zoete - Nucleic acids research, 2019 - academic.oup.com
SwissTargetPrediction is a web tool, on-line since 2014, that aims to predict the most
probable protein targets of small molecules. Predictions are based on the similarity principle …
probable protein targets of small molecules. Predictions are based on the similarity principle …
Andrographolide as a potential inhibitor of SARS-CoV-2 main protease: an in silico approach
SK Enmozhi, K Raja, I Sebastine… - Journal of biomolecular …, 2021 - Taylor & Francis
SARS-CoV-2 virus which caused the global pandemic the Coronavirus Disease-2019
(COVID-2019) has infected about 1,203,959 patients and brought forth death rate about …
(COVID-2019) has infected about 1,203,959 patients and brought forth death rate about …
[HTML][HTML] Structure based pharmacophore modeling, virtual screening, molecular docking and ADMET approaches for identification of natural anti-cancer agents …
X-linked inhibitor of apoptosis protein (XIAP) is a member of inhibitor of apoptosis protein
(IAP) family responsible for neutralizing the caspases-3, caspases-7, and caspases-9 …
(IAP) family responsible for neutralizing the caspases-3, caspases-7, and caspases-9 …