相关参考文献
注意:仅列出部分参考文献,下载原文获取全部文献信息。NCATS Inxight Drugs: a comprehensive and curated portal for translational research
Vishal B. Siramshetty et al.
NUCLEIC ACIDS RESEARCH (2022)
Antiviral phytochemicals as potent inhibitors against NS3 protease of dengue virus
Md. Mahbubur Rahman et al.
COMPUTERS IN BIOLOGY AND MEDICINE (2021)
Current Trends and Limitations in Dengue Antiviral Research
Juliet O. Obi et al.
TROPICAL MEDICINE AND INFECTIOUS DISEASE (2021)
Antidepressant activity of rose oxide essential oil: possible involvement of serotonergic transmission
Wcleubianne Matias Nascimento Maia et al.
HELIYON (2021)
AMDock: a versatile graphical tool for assisting molecular docking with Autodock Vina and Autodock4
Mario S. Valdes-Tresanco et al.
BIOLOGY DIRECT (2020)
Thioguanine-based DENV-2 NS2B/NS3 protease inhibitors: Virtual screening, synthesis, biological evaluation and molecular modelling
Maywan Hariono et al.
PLOS ONE (2019)
UniProt: a worldwide hub of protein knowledge
Alex Bateman et al.
NUCLEIC ACIDS RESEARCH (2019)
PubChem 2019 update: improved access to chemical data
Sunghwan Kim et al.
NUCLEIC ACIDS RESEARCH (2019)
DrugBank 5.0: a major update to the DrugBank database for 2018
David S. Wishart et al.
NUCLEIC ACIDS RESEARCH (2018)
The ChEMBL database in 2017
Anna Gaulton et al.
NUCLEIC ACIDS RESEARCH (2017)
Current Status of Dengue Therapeutics Research and Development
Jenny G. H. Low et al.
JOURNAL OF INFECTIOUS DISEASES (2017)
Molecular Docking Studies of Selected Medicinal Drugs as Dengue Virus-2 Protease Inhibitors
Rufaidah Othman et al.
SAINS MALAYSIANA (2017)
The Medicinal Chemistry of Dengue Virus
Mira A. M. Behnam et al.
JOURNAL OF MEDICINAL CHEMISTRY (2016)
Chemoinformatic Classification Methods and their Applicability Domain
Miriam Mathea et al.
MOLECULAR INFORMATICS (2016)
Stereoselective total synthesis of (-)-nupharamine utilizing an α-chlorosulfide and a sulfinimine for C-C bond formation
Sadagopan Raghavan et al.
ORGANIC & BIOMOLECULAR CHEMISTRY (2016)
Dengue Protease Substrate Recognition: Binding of the Prime Side
Kuan-Hung Lin et al.
ACS INFECTIOUS DISEASES (2016)
PockDrug-Server: a new web server for predicting pocket druggability on holo and apo proteins
Hiba Abi Hussein et al.
NUCLEIC ACIDS RESEARCH (2015)
NS3 and NS5 Proteins: Important Targets for Anti-Dengue Drug Design
Andre S. de Oliveira et al.
JOURNAL OF THE BRAZILIAN CHEMICAL SOCIETY (2014)
NS3 protease inhibitors for treatment of chronic hepatitis C: Efficacy and safety
Igor Bakulin et al.
WORLD JOURNAL OF HEPATOLOGY (2014)
In silico drug repositioning - what we need to know
Zhichao Liu et al.
DRUG DISCOVERY TODAY (2013)
A Unified Proteochemometric Model for Prediction of Inhibition of Cytochrome P450 Isoforms
Maris Lapins et al.
PLOS ONE (2013)
SWEETLEAD: an In Silico Database of Approved Drugs, Regulated Chemicals, and Herbal Isolates for Computer-Aided Drug Discovery
Paul A. Novick et al.
PLOS ONE (2013)
Novel antiviral activity of baicalein against dengue virus
Keivan Zandi et al.
BMC COMPLEMENTARY AND ALTERNATIVE MEDICINE (2012)
Protegrin-1 Inhibits Dengue NS2B-NS3 Serine Protease and Viral Replication in MK2 Cells
Hussin A. Rothan et al.
JOURNAL OF BIOMEDICINE AND BIOTECHNOLOGY (2012)
Dissecting Kinase Profiling Data to Predict Activity and Understand Cross-Reactivity of Kinase Inhibitors
Satoshi Niijima et al.
JOURNAL OF CHEMICAL INFORMATION AND MODELING (2012)
How similar are those molecules after all? Use two descriptors and you will have three different answers
Andreas Bender
EXPERT OPINION ON DRUG DISCOVERY (2010)
Extended-Connectivity Fingerprints
David Rogers et al.
JOURNAL OF CHEMICAL INFORMATION AND MODELING (2010)
Software News and Update AutoDock Vina: Improving the Speed and Accuracy of Docking with a New Scoring Function, Efficient Optimization, and Multithreading
Oleg Trott et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2010)
Understanding and Predicting Druggability. A High-Throughput Method for Detection of Drug Binding Sites
Peter Schmidtke et al.
JOURNAL OF MEDICINAL CHEMISTRY (2010)
Analysis of Food and Drug Administration-Approved Anticancer Agents in the NCI60 Panel of Human Tumor Cell Lines
Susan L. Holbeck et al.
MOLECULAR CANCER THERAPEUTICS (2010)
Structure-based discovery of dengue virus protease inhibitors
Suzanne M. Tomlinson et al.
ANTIVIRAL RESEARCH (2009)
Predictive QSAR workflow for the in silico identification and screening of novel HDAC inhibitors
Georgia Melagraki et al.
MOLECULAR DIVERSITY (2009)
Docking of noncompetitive inhibitors into dengue virus type 2 protease: Understanding the interactions with allosteric binding sites
Rozana Othman et al.
JOURNAL OF CHEMICAL INFORMATION AND MODELING (2008)
Development and evaluation of a QSPR model for the prediction of diamagnetic susceptibility
Antreas Afantitis et al.
QSAR & COMBINATORIAL SCIENCE (2008)
BindingDB: a web-accessible database of experimentally determined protein-ligand binding affinities
Tiqing Liu et al.
NUCLEIC ACIDS RESEARCH (2007)
Bio3d: an R package for the comparative analysis of protein structures
Barry J. Grant et al.
BIOINFORMATICS (2006)
Inhibitory activity of cyclohexenyl chalcone derivatives and flavonoids of fingerroot, Boesenbergia rotunda (L.), towards dengue-2 virus NS3 protease
Tan Siew Kiat et al.
BIOORGANIC & MEDICINAL CHEMISTRY LETTERS (2006)
MUSCLE: multiple sequence alignment with high accuracy and high throughput
RC Edgar
NUCLEIC ACIDS RESEARCH (2004)
PDB2PQR: an automated pipeline for the setup of Poisson-Boltzmann electrostatics calculations
TJ Dolinsky et al.
NUCLEIC ACIDS RESEARCH (2004)
Activity of recombinant dengue 2 virus NS3 protease in the presence of a truncated NS2B co-factor, small peptide substrates, and inhibitors
D Leung et al.
JOURNAL OF BIOLOGICAL CHEMISTRY (2001)
A novel serine protease inhibition motif involving a multi-centered short hydrogen bonding network at the active site
BA Katz et al.
JOURNAL OF MOLECULAR BIOLOGY (2001)