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Molinspiration Publications 2018 |
Exploration of novel human tyrosinase inhibitors by molecular modeling, docking and simulation studies
M Hassan, Z Ashraf, Q Abbas, H Raza… - Interdisciplinary Sciences …, 2018 - Springer
Petra, osiris and molinspiration: A computational bioinformatic platform for experimental in vitro antibacterial activity of annulated uracil derivatives
AR Bhat - Iranian Chemical Communication, 2018 - icc.journals.pnu.ac.ir
Computational Analysis of Pharmacokinetic, Bioactivity and Toxicity Parameters of Some Selected Oral-hypoglycaemic Agents Shashank Shekhar Mishra …
S Sharma, HP Singh - chemrj.org
IN SILICO PHARMACOKINETIC, BIOACTIVITY AND TOXICITY STUDY OF SOME SELECTED ANTI-ASTHMATIC AGENTS
CSS Sharma, SS Mishra, N Kumar, HP Singh… - International Journal of …, 2018 - ijpsdr.com
Prediction of Novel Anti-Ebola Virus Compounds Utilizing Artificial Neural Network (ANN)
R Bartzatt - World Journal of Pharmaceutical …, 2018 - digitalcommons.unomaha.edu
In Silico and In Vitro Investigation of the Antifungal Activity of Isoeugenol against Penicillium citrinum.
SB Ferreira, TB Dantas, PB Ferreira - Current topics in medicinal …, 2018 - europepmc.org
Understanding health-related properties of bushmint (Hyptis) by pharmacokinetic modelling of intestinal absorption
J Selby-Pham, SNB Selby-Pham, K Wise… - Phytochemistry …, 2018 - Elsevier
Synthesis, In silico Molecular Docking Study and Anti-bacterial Evaluation of some Novel 4-Anilino Quinazolines
K Hemalatha, J Selvin, K Girija - Asian Journal of Pharmaceutical …, 2018 - asianjpr.com
In silico approach to study the metabolism and biological activities of oligomeric proanthocyanidin complexes
S Jamuna, A Rathinavel, SSM Sadullah… - Indian Journal of …, 2018 - ncbi.nlm.nih.gov
Structure-based analysis of curcumin and conventional drugs targeting tumor-inducing protein PHF20
V Agrawal, A Mishra, S Tiwari, AK Srivastava - Bioinformation, 2018 - bioinformation.net
IN SILICO DESIGNING AND MOLECULAR DOCKING STUDIES OF NEWLY PROPOSED COMPOUNDS FOR PARKINSON'S DISEASE
M Mondal, R Banerjee - researchgate.net
MOLECULAR DOCKING AND MOLECULAR DYNAMICS STUDIES OF QUASSINOIDS AS HIV-1 TAT INHIBITORS
M Radha, RN Soundarya, J Suganya… - INTERNATIONAL …, 2018 - ijpsr.com
5-Hydroxy-3-(4-hydroxyphenyl)-8, 8-dimethyl-6-(3-methylbut-2-enyl) pyrano [2, 3-h] chromen-4-one
G Ribaudo, A Ongaro, G Zagotto - Molbank, 2018 - mdpi.com
Ethnomedicine claim directed in Silico prediction of anticancer activity
B Girma, E Mulisa, S Tessema, W Amelo - Ethiopian journal of health …, 2018 - ajol.info
Pharmacokinetic properties of phytochemicals in Hypericum perforatum influence efficacy of regulating oxidative stress
K Wise, S Selby-Pham, L Bennett, J Selby-Pham - Phytomedicine, 2018 - Elsevier
In silico design, docking, and synthesis of 3-hydroxy-3-methylglutaryl-coenzyme A reductase inhibitors.
S Arunkumar, N Ramalakshmi… - Drug Invention …, 2018 - search.ebscohost.com
Synthesis and Properties of N-(R-Adamantan-1-ylalkyl)-N′-[3(4)-fluorophenyl]thioureas—Target-Oriented Human Soluble Epoxide Hydrolase (hsEH) Inhibitors
DA Pitushkin, VV Burmistrov, GM Butov - Russian Journal of Organic …, 2018 - Springer
A biological, fluorescence and computational examination of synthetic coumarin derivatives with antithrombotic potential
K Kasperkiewicz, MB Ponczek, E Budzisz - Pharmacological Reports, 2018 - Elsevier
Phytochemical screening and in silico studies of flavonoids from Chlorella pyrenoidosa
R Yadavalli, JR Peasari, P Mamindla, S Mounika… - Informatics in Medicine …, 2018 - Elsevier
Molecular Docking Studies of MMP25 in Asthma
Y Joshi, S GajulP - ijiset.com
Pharmacophore Screening and Docking studies of AMPA Receptor Implicated in Alzheimer's disease with Some CNS Acting Phytocompounds from Selected …
P Bagchi, M Anuradha, A Kar - 2018 - jneuropsychiatry.org
Small Molecule Compounds Targeting the Bacterial Cell Wall for Bacterial Growth Inhibition
R Bartzatt - researchgate.net
Synthesis and Properties of N-[R-Adamantan-1(2)-yl]-N′-(2-fluorophenyl)ureas—Target-Oriented Soluble Epoxide Hydrolase Inhibitors
VV Burmistrov, GM Butov - Russian Journal of Organic Chemistry, 2018 - Springer
Synthesis, Characterization, Anthelmintic and Insilico Evaluation of 4, 6-Disubstituted Pyrimidine-2-One Derivatives
K Sudha Rani, J Lakshmi Durga, M Srilatha, M Sravani… - derpharmachemica.com
Cholinesterase Inhibitory Activity of Some Semi-rigid Spiro Heterocycles: POM Analyses and Crystalline Structure of Pharmacophore Site
TB Hadda, O Talhi, ASM Silva, FS Senol… - Mini reviews in …, 2018 - ingentaconnect.com
Potential deoxycytidine kinase inhibitory activity of amaryllidaceae alkaloids: An in silico approach
BA Yousef, AI Dirar, MAA Elbadawi… - Journal of pharmacy …, 2018 - ncbi.nlm.nih.gov
Synthesis, Characterization, and Antimicrobial Assessment of Some Computationally Bioactive 1, 2-Oxazole Derivatives
M Arshad - Russian Journal of General Chemistry, 2018 - Springer
Deciphering the role of Sodium Lignosulfonate against Candida spp. as persuasive anticandidal agent
A Jha, A Kumar - International journal of biological macromolecules, 2018 - Elsevier
A novel and efficient synthesis of 3, 4-dihydroxyphenylacetic ester and amide derivatives/conjugates and assessment of their antioxidant activity
A Pagoni, S Vassiliou - Natural product research, 2018 - Taylor & Francis
Molecular Designing, Virtual Screening and Docking Study of Novel Curcumin Analogue as Mutation (S769L And K846R) Selective Inhibitor for EGFR
NA Shaik, HM Al-Kreathy, GM Ajabnoor… - Saudi Journal of …, 2018 - Elsevier
Design, synthesis and biological evaluation of novel thiadiazole derivatives as antihyperlipidemic agents
P Jacob, B Thomas, N Santhosh - International Journal of …, 2018 - indianjournals.com
Structure based docking studies of GLUT4 towards exploring selected phytochemicals from Somalia xanthocarpum as a therapeutic target for the treatment of cancer.
BE Oyinloye, TA Adekiya, RT Aruleba… - Current drug …, 2018 - ncbi.nlm.nih.gov
Evaluation of kinetic data: What the numbers tell us about PRMTs
A Frankel, JI Brown - Biochimica et Biophysica Acta (BBA)-Proteins and …, 2018 - Elsevier
Table of log P values and predicted bioactivity scores Log P Bioactivity calculated score [C] Compound [A][B][C][DF] GPCR ligand Ion channel modulator Kinase …
P Log - Mem Inst Oswaldo Cruz, Rio de Janeiro, 2018 - SciELO Brasil
Discovery of Novel Flavonoid Analogues as Angiotensin Converting Enzyme Inhibitors based on Pharmacophore Modelling and Virtual Screening Techniques
KA Kumar, P Jagannath… - Research Journal of …, 2018 - indianjournals.com
Updated Definition of the Three Solvent Descriptors Related to the Van der Waals Forces in Solutions
P Laffort - Open Journal of Physical Chemistry, 2018 - scirp.org
In silico analysis of Mentha pipertia (phyto-constituents) as HMG coa reductase and squalene synthase inhibitors.
N Radhakrishnan, KW Lam… - … Food Research Journal, 2018 - search.ebscohost.com
Novel insights into nucleoamino acids: biomolecular recognition and aggregation studies of a thymine-conjugated l-phenyl alanine
GN Roviello - Amino acids, 2018 - Springer
Caffeic acid has antipromastigote activity by apoptosis-like process; and anti-amastigote by TNF-α/ROS/NO production and decreased of iron availability
BT da Silva Bortoleti, F Tomiotto-Pellissier… - Phytomedicine, 2018 - Elsevier
β-Carboline derivatives as novel antivirals for herpes simplex virus
MM Gonzalez, FM Cabrerizo, A Baiker… - International journal of …, 2018 - Elsevier
Predictive models for tyrosinase inhibitors: Challenges from heterogeneous activity data determined by different experimental protocols
H Tang, F Cui, L Liu, Y Li - Computational biology and chemistry, 2018 - Elsevier
PARTIAL PURIFICATION AND QUORUM SENSING INHIBITION OF SYZYGIUM AROMATICUM ON PSEUDOMONAS AERUGINOSA–AN IN VITRO AND IN …
N ALLURI, W MUTUNGWA, M MAJUMDAR - ijbpas.com
Chromatographic and Computational Studies of Molecular Lipophilicity and Drug-likeness for few 2-Thioxo-1, 3-Thiazolidin-4-one Derivatives and their Analogs
R Zakrzewski, P Urbaniak, A Nowicki… - Journal of …, 2018 - academic.oup.com
An eco-friendly catalytic system for multicomponent, one-pot synthesis of novel spiro-chromeno indoline-triones and their anti-prostate cancer potentials evaluated via …
MR Kumar, A Manikandan, A Sivakumar… - Bioorganic …, 2018 - Elsevier
IN SILICO EVALUATION OF SELECTED BENZIMIDAZOLE DERIVATIVES IN THE DISCOVERY OF NEW POTENT ANTIMICROBIAL AGENTS
JV Živković, SG Kalauzović, MR Milosavljević… - publisher.medfak.ni.ac.rs
Indole Alkaloids as New Leads for the Design and Development of Novel DPP-IV Inhibitors for the Treatment of Diabetes
KN Dhiraviam, S Balasubramanian… - Current …, 2018 - ingentaconnect.com
Is tartrazine really safe? In silico and ex vivo toxicological studies in human leukocytes: a question of dose
JM Floriano, E da Rosa, QDF do Amaral… - Toxicology …, 2018 - pubs.rsc.org
A Docking Study on Various Secondary Metabolites from W. somnifera on Tetrahydrodipicolinate N-Succinyltransferase Protein Involved in The Lysine …
AK Nagwani, D Kashya - Mol Bio, 2018 - researchgate.net
Isopropyl Caffeate: A Caffeic Acid Derivative—Antioxidant Potential and Toxicity
AB Lira, CA Montenegro, KM de Oliveira… - … medicine and cellular …, 2018 - hindawi.com
TNK2 as a key drug target for the treatment of metastatic colorectal cancer
L Qi, Y Ding - International journal of biological macromolecules, 2018 - Elsevier
Synthesis, Characterization and Bio Evaluation of N-(substituted)-2-[4-oxo-2-Phenylquinazolin-3 (4H)-yl] Acetohydrazide Derivatives
AP Chaudhary, P Kant - researchgate.net
Calculated antioxidant activity of selected Phenolic Compounds
S Cotes, J Cotuá, A Muñoz - Canadian Journal of Chemistry, 2018 - NRC Research Press
Grandiflorenic acid promotes death of promastigotes via apoptosis-like mechanism and affects amastigotes by increasing total iron bound capacity
BT da Silva Bortoleti, MD Gonçalves… - Phytomedicine, 2018 - Elsevier
Design synthesis and biological screening of heterocycles with azetidinone thiazolidinone and related rings
B Thomas - 2018 - shodhgangotri.inflibnet.ac.in
Synthesis, characterization, computational studies and biological activity evaluation of Cu, Fe, Co and Zn complexes with 2-butanone thiosemicarbazone and …
T Khan, I Azad, R Ahmad, S Raza, S Dixit, S Joshi… - EXCLI …, 2018 - ncbi.nlm.nih.gov
Design, synthesis, characterization, and biological evaluation of some novel antitubercular agents targeting thymidylate synthetase x, enoyl-ACP reductase, and …
AJ Suresh, SG Lakshmi, VS Kumar… - Journal of Pharmacy …, 2018 - jprsolutions.info
Antibacterial activity of synthetic pyrido [2, 3-d] pyrimidines armed with nitrile groups: POM analysis and identification of pharmacophore sites of nitriles as important …
RS Dongre, JS Meshram, RS Selokar… - New Journal of …, 2018 - pubs.rsc.org
Successful Green Synthesis of Gold Nanoparticles using a Corchorus olitorius Extract and Their Antiproliferative Effect in Cancer Cells
E Ismail, A Saqer, E Assirey, A Naqvi… - International journal of …, 2018 - mdpi.com
Studying the chemical reactivity properties of the target tumor-environment tripeptides NGR (asparagine-glycine-arginine) and RGD (arginine-glycine-aspartic acid) in …
LL Landeros-Martínez, D Glossman-Mitnik… - Journal of molecular …, 2018 - Springer
A Computational Study of Anticancer Activity of Curcumin Derivatives Using in silico Drug Designing and Molecular Docking Tools.
S SHEFRIN, AA MANAKADAN… - Asian Journal of …, 2018 - search.ebscohost.com
Design and screening of syringic acid analogues as BAX activators-An in silico approach to discover “BH3 mimetics”
S Cheemanapalli, CM Anuradha, SB Pakala… - … biology and chemistry, 2018 - Elsevier
(E)-N-Aryl-2-oxo-2-(3, 4, 5-trimethoxyphenyl) acetohydrazonoyl cyanides as tubulin polymerization inhibitors: Structure-based bioisosterism design, synthesis …
G Wang, Z Peng, S Peng, J Qiu, Y Li, Y Lan - Bioorganic & medicinal …, 2018 - Elsevier
fiponline.edu.br ANÁLISE FARMACOLÓGICA E TOXICOLÓGICA IN SILICO DO FLAVONOIDE 5-HIDROXI-4', 7-DIMETOXIFLAVONA
VF de Oliveiral, HMBF de Oliveira, CIS Medeiros… - jmhp.fiponline.edu.br
Chromatographic analysis of phytochemicals in Costus igneus and computational studies of flavonoids
J reddy Peasari, S sri Motamarry, KS Varma… - Informatics in Medicine …, 2018 - Elsevier
Discovery of novel drug candidates for inhibition of soluble epoxide hydrolase of arachidonic acid cascade pathway implicated in atherosclerosis
AB Gurung, B Mayengbam, A Bhattacharjee - Computational biology and …, 2018 - Elsevier
In silico drug design for Staphylococcus aureus and development of host-pathogen interaction network
RM Wadapurkar, MD Shilpa, AKS Katti… - Informatics in Medicine …, 2018 - Elsevier
A systematic toxicity evaluation of cephalosporins via transcriptomics in zebrafish and in silico ADMET studies
Y Han, J Zhang, C Hu - Food and Chemical Toxicology, 2018 - Elsevier
Pharmacokinetic Profiling of Some Carbohydrate Derivatives and Their Structure Activity Relationship Evaluation
J Trifunovic, V Borcic, S Vukmirovic… - Current Pharmaceutical …, 2018 - ingentaconnect.com
Dehydroabietic acid isolated from Pinus elliottii exerts in vitro antileishmanial action by pro-oxidant effect, inducing ROS production in promastigote and …
MD Gonçalves, BTS Bortoleti, F Tomiotto-Pellissier… - Fitoterapia, 2018 - Elsevier
Computer-aided Drug Design and Drug Pharmacokinetic Prediction: A Mini-review
J Tabeshpour, A Sahebkar, MR Zirak… - Current …, 2018 - ingentaconnect.com
Design of Drugs by Filtering Through ADMET, Physicochemical and Ligand-Target Flexibility Properties
M Martínez-Archundia, M Bello, J Correa-Basurto - Rational Drug Design, 2018 - Springer
POM analyses, immunomodulatory, cytotoxic activities and polyphenolic constituents of Callistemon viridiflorus fruits
MIS Abdelhady, AM Kamal, MF Barghash - Bulletin of Faculty of Pharmacy …, 2018 - Elsevier
In Silico Prediction of Anticonvulsant Activity of N-(2, 2, 2-Trichloro-1-hydroxyethyl) alkenyl-and–alkylarylcarboxamides
PV Zadorozhnii, NP Popykhach… - Research Journal of …, 2018 - search.proquest.com
Green Synthesis of Fluorescent Peptidomimetic Triazoles from Biomass‐Derived 5‐(Chloromethyl) furfural
KMM Salim, A Shamsiya, B Damodaran - ChemistrySelect, 2018 - Wiley Online Library
Finding novel anti-carcinomas compounds by targeting SFRP4 through molecular modeling, docking and dynamic simulation studies
M Hassan, M Azhar, Q Abbas, H Raza… - … computer-aided drug …, 2018 - ingentaconnect.com
Prediction of active compounds from SMILES codes using backpropagation algorithm
DE Ratnawati, Marjono, S Anam - AIP Conference Proceedings, 2018 - aip.scitation.org
Computational Approaches to Develop Isoquinoline Based Antibiotics through DNA Gyrase Inhibition Mechanisms Unveiled through Antibacterial Evaluation and …
M Alagumuthu, VP Muralidharan, M Andrew… - Molecular …, 2018 - Wiley Online Library
An immunopharmacoinformatics approach in development of vaccine and drug candidates for West Nile virus
MU Hossain, CA Keya, KC Das, A Hashem… - Frontiers in …, 2018 - ncbi.nlm.nih.gov
MICROWAVE ASSISTED SYNTHESIS, ANTIMICROBIAL ACTIVITY AND IN SILICO PHARMACOKINETIC STUDY OF SOME NOVEL 1', 3', 4'-OXADIAZOLE …
S Bhati - rasayanjournal.co.in
Antiproliferative potential of solidagenone isolated of Solidago chilensis
DB Gomes, B Zanchet, G Locateli… - Revista Brasileira de …, 2018 - Elsevier
Metal free synthesis, docking studies and antimicrobial screening of novel isomeric pyridine substituted thiazole derivatives
M Suryawanshi, A Patil, A Bholay, V Bobade - 2018 - nopr.niscair.res.in
Identification of potent and selective COX-2 inhibitors via structure-based virtual screening and molecular dynamics simulation
N Razzaghi-Asl, S Mirzayi, K Mahnam… - Journal of Molecular …, 2018 - Elsevier
Cytotoxic phloroglucinol meroterpenoid from Eugenia umbelliflora fruits
IV Farias, LG Faqueti, VF Noldin, GF Junior… - Phytochemistry …, 2018 - Elsevier
Multidrug resistance reversal activity of extract and a rare dimeric naphthoquinone from Diospyros lotus.
A Rauf, U Shaheen, M Raza, G Uddin… - Pakistan journal of …, 2018 - search.ebscohost.com
2‐Mercaptoquinoline Analogues: A Potent Antileishmanial Agent
S Koley, N Tiwari, RK Singh, MS Singh - ChemistrySelect, 2018 - Wiley Online Library
Molecular Docking Studies of Alpinia galanga Phytoconstituents for Psychostimulant Activity
S Sivanandan, S Pimple - Advances in Biological Chemistry, 2018 - scirp.org
Decoding the antineoplastic efficacy of Aplysin targeting Bcl-2: A de novo perspective
E Shakeel, N Sharma, S Akhtar, MKA Khan… - … biology and chemistry, 2018 - Elsevier
Investigation of hydro-lipophilic properties of N-alkoxyphenylhydroxynaphthalenecarboxamides
I Kapustikova, A Bak, T Gonec, J Kos, V Kozik… - Molecules, 2018 - mdpi.com
Bexarotene Binds to the Amyloid Precursor Protein Transmembrane Domain, Alters Its α-Helical Conformation, and Inhibits γ-Secretase Nonselectively in Liposomes
F Kamp, HA Scheidt, E Winkler, G Basset… - ACS chemical …, 2018 - ACS Publications
Isopropyl caffeate, a caffeic acid derivative: antioxidant potential and toxicity.
FFM Diniz, HLF Pessôa - downloads.hindawi.com
Eco-friendly synthesis, characterization, and drug-likeness properties of new uracils and their biological evaluation
AA Fadda, A Fekri, NM Bayoumy - Green Processing and Synthesis, 2018 - degruyter.com
Relaxant effect of structurally related flavonoids on isolated tracheal rat rings: A SAR study
A Flores-Flores, S Hidalgo-Figueroa… - Medicinal Chemistry …, 2018 - Springer
Natural products as sources of new fungicides (V): Design and synthesis of acetophenone derivatives against phytopathogenic fungi in vitro and in vivo
WJ Dan, DC Wang, D Li, AL Zhang, JM Gao - Bioorganic & medicinal …, 2018 - Elsevier
Preliminary studies of berberine and its semi-synthetic derivatives as a promising class of multi-target anti-parkinson agents
G Ribaudo, E Zanforlin, M Canton, S Bova… - Natural product …, 2018 - Taylor & Francis
Synthesis and SPAR exploration of new semicarbazone-triazole hybrids in search of potent antioxidant, antibacterial and antifungal agents
J Brahmi, S Bakari, S Nasri, H Nasri, A Kadri… - Molecular biology …, 2018 - Springer
1-(Substituted-phenylsulfonyl)-2H-thieno [2, 3-d][1, 3] oxazine-2, 4 (1H)-dione: Drug likeness, physicochemical, Synthesis, Characterization, antibacterial and …
M Arshad - ijpsr.info
Molecular property, UV-visible spectra, NMR analysis of Pyrazinamide using computational tools
A Sathya, T Prabhu, S Ramalingam - pragatipublication.com
Tetrasubstituted Imidazolium Salts as Potent Antiparasitic Agents against African and American Trypanosomiases
O Ghashghaei, N Kielland, M Revés, MC Taylor… - Molecules, 2018 - mdpi.com
Electrolyte cation length influences electrosorption and dynamics in porous carbon supercapacitors
B Dyatkin, NC Osti, A Gallegos, Y Zhang, E Mamontov… - Electrochimica …, 2018 - Elsevier
Antibacterial activity and virtual screening by molecular docking of lycorine from Pancratium foetidum Pom (Moroccan endemic Amaryllidaceae)
H Bendaif, A Melhaoui, M Ramdani, H Elmsellem… - Microbial …, 2018 - Elsevier
Structural analysis of the inhibitory effects of polyphenols,(+)‐hopeaphenol and (−)‐isohopeaphenol, on human SIRT1
A Loisruangsin, K Hikita, N Seto, M Niwa, Y Takaya… - …, 2018 - Wiley Online Library
ADNCD: a compendious database on anti-diabetic natural compounds focusing on mechanism of action
A Khatoon, I Rashid, S Shaikh, SMD Rizvi, S Shakil… - 3 Biotech, 2018 - Springer
IN-SILICO DESIGN, SYNTHESIS AND IN-VITRO ANTI-TUBERCULAR AND ANTI-MICROBIAL SCREENING OF NOVEL BENZIMIDAZOLE DERIVATIVES
PT Manju, AA Smith, V Padmaja - INTERNATIONAL JOURNAL OF …, 2018 - ijpsr.com
Određivanje lipofilnosti β-hidroksi-β-arilalkanskih kiselina primenom reverzno-fazne tečne hromatografije pod visokim pritiskom
J Savić, S Dilber, M Crevar-Sakač… - Arhiv za …, 2018 - scindeks-clanci.ceon.rs
Updated Definition of the Three Solvent Descriptors Related to the Van der Waals Forces in Solutions
P Laffort - 2018 - repository.embuni.ac.ke
Chemical Reactivity Properties, pKa Values, AGEs Inhibitor Abilities and Bioactivity Scores of the Mirabamides A–H Peptides of Marine Origin Studied by Means of …
J Frau, N Flores-Holguín, D Glossman-Mitnik - Marine drugs, 2018 - mdpi.com
SYNTHESIS, CHARACTERIZATION AND BIOLOGICAL EVALUATION OF IMIDAZOLO-CHALCONE DERIVATIVES
H Sattu, P Swathi - 2018 - wjpps.com
Understanding the inhibitory mechanism of tea polyphenols against tyrosinase using fluorescence spectroscopy, cyclic voltammetry, oximetry, and molecular …
H Tang, F Cui, H Li, Q Huang, Y Li - RSC Advances, 2018 - pubs.rsc.org
Optimization of a Vaginal Suppository Formulation to Deliver SHetA2 as a Novel Treatment for Cervical Dysplasia
S Mahjabeen, MK Hatipoglu, V Chandra… - Journal of …, 2018 - Elsevier
Bioassay-guided isolation of anti-seizure principles from Semen Pharbitidis using a zebrafish pentylenetetrazol seizure model
M Liu, D Copmans, JG Lu, MR Yang, J Sourbron… - Journal of …, 2018 - Elsevier
Deciphering the absorption profile and interaction of multi-components of Zhi-Zi-Da-Huang decoction based on in vitro–in silico–in vivo integrated strategy
Q Hu, X Li, Q Shi, G Yang, F Feng - Xenobiotica, 2018 - Taylor & Francis
Novel medium-throughput technique for investigating drug-cyclodextrin complexation by pH-metric titration using the partition coefficient method
G Dargó, K Boros, L Péter, M Malanga… - International journal of …, 2018 - Elsevier
Extrapolation of Phenolic compounds as Multi-target Agents against Cancer and Inflammation.
N Kumar, S Gupta, TC Yadav, V Pruthi… - … structure & dynamics, 2018 - researchgate.net
Synthesis, characterization, antimicrobial activity and DFT studies of 2-(pyrimidin-2-ylamino) naphthalene-1, 4-dione and its Mn (II), Co (II), Ni (II) and Zn (II) complexes
F Chioma, AC Ekennia, CU Ibeji, SN Okafor… - Journal of Molecular …, 2018 - Elsevier
Identification and in silico screening of biologically active secondary metabolites isolated from Trichoderma harzianum
A Mishra, S Dixit, V Ratan… - ANNALS OF …, 2018 - ukaazpublications.com
Synthesis and evaluation of novel coumarin-oxime ethers as potential anti-tubercular agents: Their DNA cleavage ability and BSA interaction study
DS Reddy, M Kongot, SP Netalkar, MM Kurjogi… - European journal of …, 2018 - Elsevier
A new insight into identification of in silico analysis of natural compounds targeting GPR120
N Chinthakunta, S Cheemanapalli… - … Modeling Analysis in …, 2018 - Springer
Facile synthesis of semi-library of low charge density cationic polyesters from poly (alkylene maleate) s for efficient local gene delivery
H Yan, D Zhu, Z Zhou, X Liu, Y Piao, Z Zhang, X Liu… - Biomaterials, 2018 - Elsevier
Structural insight into the antagonistic action of diarylheptanoid on human estrogen receptor alpha
Y Geetha Rani, BS Lakshmi - Journal of Biomolecular Structure and …, 2018 - Taylor & Francis
Structure based virtual screening of the Ebola virus trimeric glycoprotein using consensus scoring
AT Onawole, TU Kolapo, KO Sulaiman… - … biology and chemistry, 2018 - Elsevier
Design and Synthesis of Imidazo[1,2‐a]pyridines with Carboxamide Group Substitution and In silico Evaluation of their Interaction with a LuxR‐type Quorum Sensing …
JE Reynoso Lara, H Salgado‐Zamora… - Journal of …, 2018 - Wiley Online Library
In silico ADME PROFILING OF IBD DRUGS AND NUTRIENTS
E Brusač, A Mornar, B Nigović - XII. susret mladih kemijskih inženjera, 2018 - bib.irb.hr
PREDIÇÃO IN SILICO DE PROPRIEDADES MOLECULARES DE COMPOSTOS NATURAIS COM ATIVIDADE PURGATIVA
MIGÇS Teixeira, JFDAS BARROS… - … Universitários da UFC - periodicos.ufc.br
Mengidentifikasi Peptida Bioaktif Angiotensin Converting Enzyme-inhibitor (ACEi) dari Kasein β Susu Kambing dengan Polimorfismenya Melalui Teknik In Silico
HS Widodo, TW Murti, A Agus… - Jurnal Aplikasi …, 2018 - ejournal2.undip.ac.id
Diazabenzo [a] phenoxazone sulphonamides: synthesis, in-silico and in-vitro antimicrobial studies
MA Ezeokonkwo, CC Eze, SN Okafor… - Medicinal Chemistry …, 2018 - Springer
Molecular Docking Studies and ADMET Properties of New 1.2. 3 Triazole Derivatives for Anti-Breast Cancer Activity
M Ouassaf, S Belaidi, K Lotfy, I Daoud… - Journal of …, 2018 - ingentaconnect.com
Computational investigation of marine bioactive compounds against E6 oncoprotein of Human Papilloma Virus-HPV16
P Dhamodharan, N Ponnusamy… - Journal of Applied …, 2018 - japsonline.com
Application of salting-out thin layer chromatography in computational prediction of minimum inhibitory concentration and blood-brain barrier penetration of some …
AH Rageh, NN Atia, HM Abdel-Rahman - Journal of pharmaceutical and …, 2018 - Elsevier
Synthesis and evaluation of novel 1, 3, 4-thiadiazole--fluoroquinolone hybrids as antibacterial, antituberculosis, and anticancer agents
A DEMİRCİ, KG KARAYEL, E TATAR… - Turkish Journal of …, 2018 - journals.tubitak.gov.tr
Synthesis, Characterization, Computational, Antimicrobial Screening, and MTT Assay of Thiazolidinone Derivatives Containing the Indole and Pyridine Moieties
M Arshad, MS Khan, SAA Nami, D Ahmad - Russian Journal of General …, 2018 - Springer
Identification of small molecule activators for ErbB 4 receptor to enhance oligodendrocyte regeneration by in silico approach
M Joshi, S Singh, S Patel, D Shah… - Computational …, 2018 - Elsevier
A step-ladder manganese (iii) metallacrown hosting mefenamic acid and a manganese (ii)–mefanamato complex: synthesis, characterization and cytotoxic activity
A Tarushi, GD Geromichalos, K Lafazanis… - New Journal of …, 2018 - pubs.rsc.org
Design, synthesis and antimycobacterial activity of novel nitrobenzamide derivatives
H Wang, K Lv, X Li, B Wang, A Wang, Z Tao… - Chinese Chemical …, 2018 - Elsevier
Design, Synthesis and Biological Evaluation of Novel Dihydropyrimidine-2-Thione Derivatives as Potent Antimicrobial Agents: Experimental and Molecular Docking …
EU Mughal, A Sadiq, M Hamayun… - Letters in Drug …, 2018 - ingentaconnect.com
In silico evaluation of Benzo (f) chromen-3-one as a potential inhibitor of NF-κB: A key regulatory molecule in inflammation-mediated pathogenesis of diabetes …
SK Gandham, VR Chintha… - Journal of Applied …, 2018 - japsonline.com
Engineering Biocompatible Scaffolds through the Design of Elastin‐Based Short Peptides
M Hassan, AD Martin, P Thordarson - ChemPlusChem, 2018 - Wiley Online Library
Pass and Swiss ADME collaborated in silico docking approach to the synthesis of certain pyrazoline spacer compounds for dihydrofolate reductase inhibition and …
K Lohidakshan, M Rajan, A Ganesh, M Paul… - Bangladesh Journal of …, 2018 - banglajol.info
Exploration of synthetic multifunctional amides as new therapeutic agents for Alzheimer's disease through enzyme inhibition, chemoinformatic properties, molecular …
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Semisynthesis, Characterization and Evaluation of New Adenosine Derivatives as Antiproliferative Agents
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THE ROLE OF PFEMP1 DBL3X IN PLACENTAL MALARIA
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New antiglioma zwitterionic pronucleotides with an FdUMP framework
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Design, Synthesis, In Vitro Anti-cancer Activity, ADMET Profile and Molecular Docking of Novel Triazolo [3, 4-a] phthalazine Derivatives Targeting VEGFR-2 Enzyme
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Dibasic Derivatives of Phenylcarbamic Acid against Mycobacterial Strains: Old Drugs and New Tricks?
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A versatile synthetic platform for amphiphilic nanogels with tunable hydrophobicity
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STUDYING OF THE LIPOPHILICITY AND TOXICITY OF DIPHENYLACETAMIDE DERIVATIVES
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SCHIFF BASES DERIVED FROM 2-HYDROXY AND 2-METHOXY NAPHTHALDEHYDE: EXPLORATION OF IN SILICO DOCKING, DNA CLEAVAGE …
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On the toxicity of para-substituted phenols and their quinone metabolites: Quantum chemical study
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Design and Fabrication of Streptavidin-Functionalized, Fluorescently Labeled Polymeric Nanocarriers
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Effect of viscosity and dielectric constant variation on fractional fluorescence quenching analysis of coumarin dye in binary solvent mixtures
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Playing with Isomerism: Cocrystallization of Isomeric N-Salicylideneaminopyridines with Perfluorinated Compounds as Halogen Bond Donors and Its Impact on …
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Leishmanicidal compounds of Nectria pseudotrichia, an endophytic fungus isolated from the plant Caesalpinia echinata (Brazilwood)
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Design, synthesis, antiproliferative activity, molecular docking and cell cycle analysis of some novel (morpholinosulfonyl) isatins with potential EGFR inhibitory activity
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A Comprehensive Review on Recent Developments in the Field of Biological Applications of Potent Pyrazolines Derived from Chalcone Precursors
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Synthesis of proline derived benzenesulfonamides: A potent anti-Trypanosoma brucei gambiense agent
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Efficient Synthesis of 2, 4, 5‐Substituted Thiazoles via Intramolecular Knoevenagel Condensation–Cyclization Reaction Using TEA under Microwave Irradiation …
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5-(Thiophen-2-yl)-1, 3, 4-thiadiazole derivatives: synthesis, molecular docking and in vitro cytotoxicity evaluation as potential anticancer agents
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In Vitro, In Silico Elucidation of Antiurease Activity, Kinetic Mechanism and COX‐2 Inhibitory Efficacy of Coagulansin A of Withania coagulans
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Synthesis and anticonvulsant activity of phenoxyacetyl derivatives of amines, including aminoalkanols and amino acids
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Design and Synthesis of Gallocyanine Inhibitors of DKK1/LRP6 Interactions for Treatment of Alzheimer's Disease
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The anti-cancer activity of an andrographolide analogue functions through a GSK-3β-independent Wnt/β-catenin signaling pathway in colorectal cancer cells
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Encapsulation of OZ439 into Nanoparticles for Supersaturated Drug Release in Oral Malaria Therapy
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Synthesis, Characterization, Molecular Docking Studies and Biological Evaluation of Some Conjugated Quinazoline‐Sulfonamide Scaffold
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Advances in the Prediction of Gastrointestinal Absorption: Quantitative Structure-Activity Relationship (QSAR) modelling of PAMPA Permeability
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INTESTINAL TARGETING OF SMALL MOLECULE MMP AND TGR5 LIGANDS FOR INFLAMMATORY BOWEL
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Polymeric Micelles of Biodegradable Diblock Copolymers: Enhanced Encapsulation of Hydrophobic Drugs
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Challenges in Creating Online Exercises and Exams in Organic Chemistry
B Jaun, C Thilgen - CHIMIA International Journal for Chemistry, 2018 - ingentaconnect.com
Synthesis and biological evaluation of novel chalcones bearing morpholine moiety as antiproliferative agents 2
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Discovery of Novel Quinoline-Chalcone Derivatives as Potent Anti-tumor Agents with Microtubule Polymerization Inhibitory Activity
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Eco-Friendly Synthesis, Characterization and Biological Evaluation of Some Novel Pyrazolines Containing Thiazole Moiety as Potential Anticancer and Antimicrobial …
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IDENTIFICATION OF ANTICANCER DRUG THROUGH STUDYING THE ACTIVATION MECHANISM OF CASPASE PROTEIN: AN IN SILICO APPROACH
MD KHAN - 2018 - library.mist.ac.bd
Synthesis and PASS-assisted evaluation of coumarin–benzimidazole derivatives as potential anti-inflammatory and anthelmintic agents
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In silico Structure-based Identification of Novel Acetylcholinesterase Inhibitors Against Alzheimer's Disease
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FINAL PROGRESS REPORT OF THE WORK DONE ON THE MAJOR RESEARCH PROJECT
CS REDDY - 2018 - mobile.svuniversity.edu.in
Novel chelators based on adamantane-derived semicarbazones and hydrazones that target multiple hallmarks of Alzheimer's disease
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Design and discovery of novel quinoxaline derivatives as dual DNA intercalators and topoisomerase II inhibitors
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Precursor-directed combinatorial biosynthesis of cephalosporin analogue by endolithic actinobacterium Streptomyces sp. AL51 by utilizing thiophene derivative
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A minimalistic approach to develop new anti-apicomplexa polyamines analogs
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Oil behavior in sea ice: changes in chemical composition and resultant effect on the complex permittivity (dielectrics) and radar signature of sea ice
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Design, synthesis and docking study of pyridine and thieno [2, 3-b] pyridine derivatives as anticancer PIM-1 kinase inhibitors
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Design, synthesis and pharmacological evaluation of some novel indanone derivatives as acetylcholinesterase inhibitors for the management of cognitive dysfunction
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Jasmonic acid, methyl jasmonate and methyl dihydrojasmonate as active compounds of topical formulations
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Combinatorial Synthesis of New Pyrimidine‐ and Purine‐ß‐D‐Ribonucleoside Nucleolipids: Their Distribution Between Aqueous and Organic Phases and Their in vitro Activity …
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유기용매상에서 WCA (Weakly Coordinating Anion) 도입이 양이온성 염료의 내광성 향상에 미치는 영향에 대한 연구
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Combined Acylselenourea–Diselenide Structures: New Potent and Selective Antitumoral Agents as Autophagy Activators
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Phthalazine-1, 4-dione derivatives as non-competitive AMPA receptor antagonists: design, synthesis, anticonvulsant evaluation, ADMET profile and molecular docking
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Overcoming P-glycoprotein mediated drug resistance with noscapine derivatives
D Muthiah, GK Henshaw, AJ DeBono… - Drug Metabolism and …, 2018 - ASPET
PEGylated PLGA nanoparticles as a smart carrier to increase the cellular uptake of a coumarin-based monoamine oxidase B inhibitor
C Fernandes, C Martins, A Fonseca… - … applied materials & …, 2018 - ACS Publications
Adjuvant therapies against tuberculosis: discovery of a 2-aminothiazole targeting Mycobacterium tuberculosis energetics
D Machado, E Azzali, I Couto, G Costantino… - Future …, 2018 - Future Medicine
One-pot synthesis of dihalogenated ring-fused benzimidazolequinones from 3, 6-Dimethoxy-2-(cycloamino) anilines using hydrogen peroxide and hydrohalic acid
M Sweeney, LAJ Keane, M Gurry, P McArdle… - Organic …, 2018 - ACS Publications
Multiplexed High-throughput Screenings for Immune Modulators of Cytotoxic T Lymphocyte
Z Zhao - opencommons.uconn.edu
Estudios in silico y Síntesis de un Potencial Inhibidor de la Transcriptasa Reversa del VIH-1
CG Arroyo-Chavero - sqm.org.mx
Synthesis and evaluation of thiazolidinone–pyrazole conjugates as anticancer and antimicrobial agents
B Poojary, M Bhat, BS Kalal, PMG Swamy, S Kabilan - 2018 - works.bepress.com
Synthesis and evaluation of thiazolidinone–pyrazole conjugates as anticancer and antimicrobial agents
M Bhat, B Poojary, BS Kalal… - Future medicinal …, 2018 - Future Science
Age-dependent deterioration of nuclear pore assembly in mitotic cells decreases transport dynamics
IL Rempel, MM Crane, A Mishra, DPM Jansen… - bioRxiv, 2018 - biorxiv.org
Interactions in poly (N-isopropylacrylamide) hydrogels
ER Manek - 2018 - repozitorium.omikk.bme.hu
Computer Processing of Chemical Structure Information
T Engel, O Sacher, A Kolodzik, M Rarey… - … : Basic Concepts and …, 2018 - books.google.com
Myotonia Therapy Through Nav Channel Slow Inactivation
PB Chen - 2018 - search.proquest.com
Design, synthesis, antimicrobial, antiquorum-sensing and antitumor evaluation of new series of pyrazolopyridine derivatives
NS El-Gohary, MI Shaaban - European journal of medicinal chemistry, 2018 - Elsevier
Anticancer properties of thiophene derivatives in breast cancer MCF-7 cells
FA Dos Santos, MC Pereira, TB de Oliveira… - Anti-cancer …, 2018 - ingentaconnect.com
Synthesis and Preliminary Antimicrobial Analysis of Isatin–Ferrocene and Isatin–Ferrocenyl Chalcone Conjugates
A Singh, G Fong, J Liu, YH Wu, K Chang, W Park… - ACS …, 2018 - ACS Publications
Potent Antimalarial Activity of Two Arenes Linked with Triamine Designed To Have Multiple Interactions with Heme
Y Sakata, K Yabunaka, Y Kobayashi… - ACS medicinal …, 2018 - ACS Publications
Medical and Biotechnological Aspects
J Walton - The Cyclic Peptide Toxins of Amanita and Other …, 2018 - Springer
W/O 型乳化物を構成するモノグリセリドの結合脂肪酸が香気成分の遊離に与える影響
塚越詩織， 松浦弘明， 塩田誠 - 日本食品科学工学会誌, 2018 - jstage.jst.go.jp
Synthesis, characterization and in vitro antitrypanosomal activities of new carboxamides bearing quinoline moiety
DI Ugwu, UC Okoro, NK Mishra - PloS one, 2018 - journals.plos.org
Design, synthesis and biological evaluation of novel 1, 3-diarylpyrazoles as cyclooxygenase inhibitors, antiplatelet and anticancer agents
N Inceler, Y Ozkan, NN Turan, DC Kahraman… - …, 2018 - pubs.rsc.org
Synthesis, antimicrobial activity and molecular modeling study of 3-(5-amino-(2H)-1, 2, 4-triazol-3-yl]-naphthyridinones as potential DNA-gyrase inhibitors
NG Mohamed, MM Sheha, HY Hassan… - Bioorganic …, 2018 - Elsevier
Efficient Synthesis and in Silico Studies of the Benzimidazole Hybrid Scaffold with the Quinolinyloxadiazole Skeleton with Potential α-Glucosidase Inhibitory …
SS Bharadwaj, B Poojary, SKM Nandish… - ACS …, 2018 - ACS Publications
Hypercoordinated Oligosilanes Based on Aminotrisphenols
M Aghazadeh Meshgi, KV Zaitsev, MV Vener… - ACS …, 2018 - ACS Publications
Iridium (III)-Catalyzed Tandem Annulation Synthesis of Pyrazolo [1, 2-α] Cinnolines from Pyrazolones and Sulfoxonium Ylides
CF Liu, M Liu, L Dong - The Journal of organic chemistry, 2018 - ACS Publications
Regiochemical Control in the Substitution Reactions of Cyclotriphosphazene Derivatives with Secondary Amines
S Beşli, C Mutlu Balcı, S Doğan… - Inorganic …, 2018 - ACS Publications
Biomedical Applications of Aromatic Azo Compounds
Y Ali, SA Hamid, U Rashid - Mini reviews in medicinal …, 2018 - ingentaconnect.com
Investigating the structural chemistry of organotin (IV) compounds: recent advances
N Rabiee, M Safarkhani, MM Amini - Reviews in Inorganic Chemistry - degruyter.com
Kontekstiperustainen verkkokurssi kemian oppimisen tukena
L Korppinen - 2018 - jyx.jyu.fi
Organocatalytic Asymmetric Domino Michael/Acyl Transfer Reaction between γ/δ-Hydroxyenones and α-Nitroketones
K Mondal, SC Pan - The Journal of organic chemistry, 2018 - ACS Publications
Talipexol als Leitstruktur zur Darstellung neuer Liganden an D2-und D3-Dopaminrezeptoren
L Stank - 2018 - docserv.uni-duesseldorf.de
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