Conference on Drug Design and Discovery Technologies

Herausgeber: Murahari, Manikanta; Nayak, Usha Y; Bhat, Pritesh; Poongavanam, Vasanthanathan; Chaki, Soma; Sundar, Lakshmi

• Gebundenes Buch

Produktbeschreibung

Aimed at scientists, students, regulators, academics and consultants throughout the world, this book is an ideal resource for anyone interested in the state of the art in drug design and discovery.

Produktdetails

• Special Publications
• Verlag: Royal Society of Chemistry
• Seitenzahl: 350
• Erscheinungstermin: 20. November 2019
• Englisch
• Abmessung: 236mm x 163mm x 25mm
• Gewicht: 706g
• ISBN-13: 9781788018623
• ISBN-10: 1788018621
• Artikelnr.: 57163187

Inhaltsangabe

Part 1: Structure Based Drug Design Approach; MOLECULAR DYNAMICS
SIMULATIONS ON BACILLUS SUBTILIS EngA - FOR EXPLORING NUCLEOTIDE DEPENDENT
CONFORMATIONS; ERRORS MADE IN AB INITIO+ HOMOLOGY-BASED PROTEIN STRUCTURE
PREDICTION TOOLS ARISE DUE TO LACK OF CONSIDERATION OF IMPACT FORCES;
PARADIGM SHIFT IN RESEARCH FOCUS: COMPUTATIONAL SOFTWARES IN CANCER
BIOLOGY; VIRTUAL SCREENING OF BIO-ACTIVE COMPOUNDS AS AN INHIBITOR OF
C-FLIP PROTEIN FOR CANCER TREATMENT; FRAGMENT-BASED DESIGN OF NOVEL
INHIBITORS OF HPV 16 E6 ONCOPROTEIN: MOLECULAR DOCKING, MOLECULAR DYNAMICS
SIMULATION AND IN SILICO ADME ANALYSIS; DESIGN AND SYNTHESIS OF NOVEL POLY
ADP-RIBOSE POLYMERASE 1 (PARP1) INHIBITORS FOR THE TREATMENT OF SOLID
TUMORS; IN SILICO EVALUATION OF THE ROLE OF PHYTOCHEMICALS IN ALZHEIMER'S
DISEASE THROUGH WNT SIGNALING MODULATION; IDENTIFICATION OF POTENTIAL
VEGFR2 INHIBITORS EMPLOYING E-PHARMACOPHORE MODEL, VIRTUAL SCREENING,
MOLECULAR DYNAMIC SIMULATION AND ADME ANALYSIS; DEVELOPMENT OF NEW
NEPRILYSIN INHIBITOR AS A MODULATOR OF CHRONIC KIDNEY AND HEART DISEASE
USING IN SILICO DRUG REPURPOSING APPROACH; ANTICANCER POTENTIAL OF
PHYTOCONSTITUENTS MODULATING NA/ K ATPASE PUMP; A NOVEL REPURPOSING
STRATEGY; IN SILICO HIT IDENTIFICATION, DRUG REPURPOSING, PHARMACOKINETIC
AND TOXICITY PREDICTION OF c-MET KINASE INHIBITORS FOR CANCER THERAPY;
DESIGN OF POTENT TELOMERASE INHIBITORS USING STRUCTURE BASED APPROACHES;
MOLECULAR DOCKING BASED SCREENING OF "NITROGEN CONTAINING BISPHOSPHONATE
CONJUGATE WITH HYDROXYAPETITE" ACTIVE CONSTITUENTS TOWARDS MELVONATE
PATHWAY IN FINDING POTENT INHIBITORS FOR ANTI-OSTEOPOROTIC ACTIVITY;
ZANAPEZIL, A POTENTIAL REPURPOSABLE DRUG AGAINST HUNTINGTON DISEASE: AN IN
SILICO FORECAST; DRUG REPURPOSING FOR HEPATOCELLULAR CARCINOMA VIA VIRTUAL
SCREENING INTEGRATED WITH BIOINFORMATICS ANALYSIS; AN IN SILICO TARGET
SPECIFIC DRUG REPURPOSING APPROACH FOR MULTIPLE SCLEROSIS; Part 2:
Structure Based Drug Design and Biological Evaluation; DESIGN, SYNTHESIS
AND BIOLOGICAL EVALUATION OF 3-PHENYLISOXAZOLO[5,4-D]PYRIMIDINE DERIVATIVES
AS ANTICANCER AGENTS.; QSAR AND DOCKING STUDIES ON TRIAZOLE BENZENE
SULFONAMIDES WITH HUMAN CARBONIC ANHYDRASE IX INHIBITORY ACTIVITY; DESIGN
AND SYNTHESIS OF SOME NOVEL ERLOTINIB DERIVATIVES AS POTENTIAL EGFR KINASE
INHIBITORS; DESIGN, SYNTHESIS AND CHARACTERIZATION OF NOVEL SERIES OF
1,3-THIAZOLE CONTAINING HETEROCYCLES AS INHIBITORS OF DHFR FOR USE AS
ANTICANCER AGENTS; IN SILICO AND IN VITRO STUDIES OF BENZOHYDRAZIDE
ANALOGUES AS POTENT ANDROGEN RECEPTOR ANTAGONIST; DESIGN, MOLECULAR
DOCKING, SYNTHESIS AND ANTI-FUNGAL ACTIVITY OF NOVEL BENZIMIDAZOLE
DERIVATIVES; SYNTHESIS, ANTIOXIDANT ACTIVITY AND COMPUTATIONAL STUDIES OF
2-SUBSTITUTED-L-THIAPROLINES; DESIGN, SYNTHESIS, CHARACTERISATION AND
ANTIFUNGAL ACTIVITY OF NOVEL PYRIMIDONE DERIVATIVES; Part 4: Chemical
Synthesis and Biological Evaluation; MICROWAVE-ASSISTED SYNTHESIS OF
4-BENZYLIDENE-2-(2-FLUOROPHENYL) OXAZOL-5(4H)-ONE DERIVATIVES CATALYSED BY
EGG SHELL POWDER AND EVALUATION OF THEIR ANTI-MICROBIAL ACTIVITY; SYNTHESIS
OF OXAZOLOQUINOLONE DERIVATIVES AND EVALUATION OF THEIR POTENCY TO
REACTIVATE RAT BRAIN ACETYLCHOLINESTERASE INHIBITED BY CHLORPYRIFOS; Part
5: