Citations Report Journal of Computational Methods in Molecular Design...

	2020	2019	2018	2017	2016
Year wise published articles	37	19	5	7	18
Year wise citations received	50	34	29	37	39

Development of a predictive model for corrosion inhibition of carbon steel by imidazole and benzimidazole derivatives View at Publisher | View at Google Scholar

Anti-corrosive Properties and Quantum Chemical Study of (E)- 4-Methoxy-N-(Methoxybenzylidene)Aniline and (E)-N-(4- Methoxybenzylidene)-4-Nitroaniline Coating on Mild Steel in Molar Hydrochloric. View at Publisher | View at Google Scholar

DFT Calculations for Corrosion Inhibition of Ferrous Alloys by Pyrazolopyrimidine Derivatives View at Publisher | View at Google Scholar

Synthesis of New 1,2,3-Triazole Derivatives of Uracil and Thymine with Potential Inhibitory Activity against Acidic Corrosion of Steels View at Publisher | View at Google Scholar

Experimental and theoretical study of [N-substituted] p-aminoazobenzene derivatives as corrosion inhibitors for mild steel in sulfuric acid solution View at Publisher | View at Google Scholar

Computational model for the acylation step of the ?-lactam ring: Potential application for l,d-transpeptidase 2 in mycobacterium tuberculosis View at Publisher | View at Google Scholar

DFT study on the adsorption mechanism of some phenyltetrazole substituted compounds as effective corrosion inhibitors for mild steel View at Publisher | View at Google Scholar

Extensive theoretical study of corrosion inhibition efficiency of some pyrimidine derivatives on iron and the proposal of new inhibitor View at Publisher | View at Google Scholar

Pyrimidine derivatives as potential corrosion inhibitors for steel in acid medium An overview View at Publisher | View at Google Scholar

The multiply version of Zagreb indices of a family of molecular graph "polycyclic aromatic hydrocarbons (PAHS)" View at Publisher | View at Google Scholar

Experimental and quantum chemical studies on corrosion inhibition performance of fluconazole in hydrochloric acid solution View at Publisher | View at Google Scholar

DFT AND QSAR STUDY OF CORROSION INHIBITION ON 3,5-DI-SUBSTITUTED PYRAZOLE DERIVATIVES WITH HETEROATOM ON POSITION ONE View at Publisher | View at Google Scholar

Study of Bitter Leaves Extract as Inhibitive Agent in HCl Medium for the Treatment of Mild Steel through Pickling View at Publisher | View at Google Scholar

Study of Some [N-substituted] p-aminoazobenzene as Corrosion Inhibitors for Mild-Steel in 1M H2SO4 View at Publisher | View at Google Scholar

New results on eccentric connectivity indices of V-Phenylenic nanotube View at Publisher | View at Google Scholar

An Imidazole-Based Antifungal Drug as a Corrosion Inhibitor for Steel in Hydrochloric Acid View at Publisher | View at Google Scholar

DFT-QSAR studies on corrosion inhibition efficiency of derivatives of thiadiazole, oxadiazole and triazole View at Publisher | View at Google Scholar

The Sadhana polynomial and the Sadhana index of polycyclic aromatic hydrocarbons PAHK View at Publisher | View at Google Scholar

Quantum chemical studies on inhibition activities of 2,3-dihydroxypropyl-sulfanyl derivative on carbon steel in acidic media View at Publisher | View at Google Scholar

Aluminum Corrosion Inhibition by 7-(Ethylthiobenzimidazolyl) Theophylline in 1M Hydrochloric Acid: Experimental and DFT Studie View at Publisher | View at Google Scholar

TWO DERIVATIVES OF 7-AMINO-THIAZOLO[3,2-a]PYRIMIDINE AS INHIBITORS OF MILD STEEL CORROSION IN 1.0 M HCl SOLUTION PART II: ADSORPTION AND QUANTUM CHEMICAL STUDIES View at Publisher | View at Google Scholar

THEORETICAL STUDY ON CORROSION INHIBITION PROPERTIES OF 2-ISOPROPYL-5-METHYLPHENOL View at Publisher | View at Google Scholar

Experimental, quantum chemical studies of oxazole derivatives as corrosion inhibitors on mild steel in molar hydrochloric acid medium View at Publisher | View at Google Scholar

Theoretical assessment of Inhibitive behaviour of some Benzohydrazide Derivatives on Mild Steel. View at Publisher | View at Google Scholar

Comparative study of Levofloxacin and its amide derivative as efficient water soluble inhibitors for mild steel corrosion in hydrochloric acid solution View at Publisher | View at Google Scholar

Computing Sanskruti index of the Polycyclic Aromatic Hydrocarbons View at Publisher | View at Google Scholar

SOME ECCENTRICITY BASED TOPOLOGICAL INDICES OF TETRA SHEETS View at Publisher | View at Google Scholar

StructureActivity Relationships in the Chelation Activity by Derivatives of 1,2-Dithiole-3-Thiones View at Publisher | View at Google Scholar

The Theta Polynomial ?(G,x) and the Theta Index ?(G) of Molecular Graph Polycyclic Aromatic Hydrocarbons PAHk View at Publisher | View at Google Scholar

Thermodynamic and DFT studies on the behavior of cefadroxil drug as effective corrosion inhibitor of copper in one molar nitric acid medium View at Publisher | View at Google Scholar

THE AVERAGE ECCENTRICITY AND ECCENTRICITY BASED GEOMETRIC-ARITHMETIC INDEX OF TETRA SHEETS View at Publisher | View at Google Scholar

Synthesis, spectroscopic characterization and molecular docking study of ethyl 2-(4-(5, 9-dihydro-6-hydroxy-2-mercapto-4H-purin-8-ylthio) thiophen-2-yl)-2-oxoacetate molecule for the chemotherapeutic treatment of breast cancer cells View at Publisher | View at Google Scholar

ECCENTRICITY BASED GEOMETRIC-ARITHMETIC AND ATOM-BOND CONNECTIVITY INDICES OF COPPER OXIDE CuO View at Publisher | View at Google Scholar

ECCENTRICITY ATOM-BOND CONNECTIVITY INDEX OF POLYCYCLIC AROMATIC HYDROCARBON PAHk View at Publisher | View at Google Scholar

2-(1-(Benzylimino)ethyl)phenol as anticorrosive compound supported with Quantum chemical calculations View at Publisher | View at Google Scholar

Experimental and Theoretical Studies on the Corrosion Inhibition Performance of Molecules Containing Tert-Butyl Benzyl Group on Mild Steel in Acid Media View at Publisher | View at Google Scholar

ECCENTRICITY ATOM-BOND CONNECTIVITY INDEX OF POLYCYCLIC AROMATIC HYDROCARBON PAHk View at Publisher | View at Google Scholar

The second eccentric Zagreb index of the $N^{TH}$ growth of nanostar dendrimer $D_{3}[N]$ View at Publisher | View at Google Scholar

OPTIMASI SIFAT INHIBITOR KOROSI SENYAWA THIAAMIDA-PIRAZOLINDOL BERDASARKAN TEORI FUNGSIONAL KERAPATAN View at Publisher | View at Google Scholar

Quantum Chemical Approach for the Study of the Phytoconstituents of Araucaria heterophylla Gum (AHG) as Corrosion Inhibitor Using Density Functional Theory (DFT) View at Publisher | View at Google Scholar

COMPARATIVE STUDY OF THE INHIBITIVE PROPERTIES OF ETHANOLIC EXTRACT OF GMELINA ARBOREAON CORROSION OF ALUMINIUM IN DIFFERENT MEDIA View at Publisher | View at Google Scholar

QSPR ANALYSIS OF CERTAIN DEGREE AND ECCENTRICITY BASED TOPOLOGICAL INDICES AND BUTANE DERIVATIVES View at Publisher | View at Google Scholar

Aluminum Corrosion Inhibition by 7-(Ethylthiobenzimidazolyl) Theophylline in 1M Hydrochloric Acid: Experimental and DFT Studies View at Publisher | View at Google Scholar

Computing the fourth atom-bond connectivity index of the Polycyclic Aromatic Hydrocarbons View at Publisher | View at Google Scholar

HPLC: Isocratic or Gradient Elution and Assessment of Linearity In Analytical Methods View at Publisher | View at Google Scholar

Copper Corrosion Inhibition in 1 M Nitric Acid: Adsorption and Inhibitive Action of Theophylline View at Publisher | View at Google Scholar

Applied Mathematics and Nonlinear Sciences View at Publisher | View at Google Scholar

Effect of 2-[substituted-hydrazine]carbothioamide as corrosion inhibitors for mild steel in sulphuric acid solution View at Publisher | View at Google Scholar

COMPUTING EDGE VERSION OF Co-PI INDEX OF POLYCYCLIC AROMATIC HYDROCARBONS (PAHk) View at Publisher | View at Google Scholar

EXPERIMENTAL STUDY AND HIGH DIMENSIONAL QSAR MODELLING OF PHENYLPROPANOIDS OF ALPINIA GALANGA AS CORROSION INHIBITORS ON MILD STEEL View at Publisher | View at Google Scholar

Experimental and Theoretical Investigations on Copper Corrosion Inhibition by Cefixime Drug in 1M HNO3 Solution View at Publisher | View at Google Scholar

Vertex version of co-pi index of the polycyclic aromatic hydrocarbon systems pahk. View at Publisher | View at Google Scholar

Surface Activation of Rubber to Enhance the Durability and Chemo-Mechanics of Asphalt View at Publisher | View at Google Scholar

GENERAL ZAGREB INDEXES OF A HYDROCARBON MOLECULAR GRAPH â??POLYCYCLIC AROMATIC HYDROCARBONS (PAHK) View at Publisher | View at Google Scholar

DENSITY FUNCTIONAL THEORY OF THE EFFICIENCIES OF 2-PHENYLIMIDAZO[1,2-A]PYRIDINE AND 2-(M-METHOXYPHENYL)IMIDAZO[1,2-A] PYRIMIDINE AS CORROSION INHIBITORS FOR MILD STEEL View at Publisher | View at Google Scholar

A density functional study of the inhibition of microsomal prostaglandin E2 Synthase-1 by 2-aryl substituted quinazolin-4(3H)-one, pyrido[4,3-d] pyrimidin-4(3H)-one and pyrido[2,3-d]pyrimidin-4(3H)-one derivatives View at Publisher | View at Google Scholar

45 Years of the KPG Method: A Tribute to Federico Peradejordi View at Publisher | View at Google Scholar

A Theoretical Study of the Relationships between Electronic Structure and Cytotoxicity of a group of N2 -alkylated Quaternary ?-Carbolines against nine Tumoral Cell Lines View at Publisher | View at Google Scholar

A Quantum Chemical Analysis of the Inactivation Rate Constant of the BoNT/A LC Neurotoxin by some 1,4-Benzoquinone and 1,4-Naphthoquinone derivatives. View at Publisher | View at Google Scholar

A theoretical analysis of the relationships between electronic structure and HIV-1 integrase inhibition and antiviral activity of a series of naphthyridinone derivatives View at Publisher | View at Google Scholar

A quantum-chemical and docking study of the inhibitory activity of a family of thienopyrimidine derivatives bearing a chromone moiety against mTOR Kinase View at Publisher | View at Google Scholar

A quantum-chemical analysis of the antiproliferative activity of N-3-benzimidazolephenylbisamide derivatives against MGC803, HT29, MKN45 and SW620 cancer cell lines View at Publisher | View at Google Scholar

Quantum-chemical and docking studies of 8-hydroxy-quinolines as inhibitors of the botulinum neurotoxin a light chain (BoNT/A LC) View at Publisher | View at Google Scholar

A DFT Analysis of the Inhibition of Carbonic Anhydrase Isoforms I, II, IX and XII by a Series of Benzenesulfonamides and Tetrafluorobenzenesulfonamides View at Publisher | View at Google Scholar

OPTIMIZATION OF EXTRACTS AND CONSTITUENTS FROM ALPINIA GALANGA AS CORROSION INHIBITOR FOR MILD STEEL IN ACIDIC MEDIUM View at Publisher | View at Google Scholar

Experimental and quantum chemical studies of some derivative of decahydroacridinedione-1,8 as corrosion inhibitor of steel 17 GS in NS4 solution View at Publisher | View at Google Scholar

Platelet-rich plasma for the treatment of knee osteoarthritis: an expert opinion and proposal for a novel classification and coding system View at Publisher | View at Google Scholar

Platelet Concentrates in Musculoskeletal Medicine View at Publisher | View at Google Scholar

Medical gas plasma promotes blood coagulation via platelet activation View at Publisher | View at Google Scholar

Thiamine Hydrochloride as Copper Corrosion Inhibitor in 1M HNO3 View at Publisher | View at Google Scholar

Effect of 2-[substituted-hydrazine]carbothioamide as corrosion inhibitors for mild steel in sulphuric acid solution View at Publisher | View at Google Scholar

Theoretical Studies of Anti -corrosion Properties of Triphenylimidazole Derivatives in Corrosion Inhibition of Carbon Steel in Acidic Media via DFT View at Publisher | View at Google Scholar

Technical and biological review of authorized medical devices for platelets-rich plasma preparation in the field of regenerative medicine View at Publisher | View at Google Scholar

The different modes of docking of a series of benzenesulfonamides and tetrafluorobenzenesulfonamides to the carbonic anhydrase isoform II View at Publisher | View at Google Scholar

Electronic structure and rat fundus serotonin receptor binding affinity of phenetylamines and indolealkylamines View at Publisher | View at Google Scholar

Regenerative Injectable Therapies: Current Evidence View at Publisher | View at Google Scholar

A DFT and Docking study of the relationships between electronic structure and 5-HT2B receptor binding affinity in N-benzylphenethylamines View at Publisher | View at Google Scholar

A quantum-chemical analysis of the relationships between electronic structure and cytotoxicity, GyrB inhibition, DNA supercoiling inhibition and antitubercular activity of a series of quinolineaminopiperidine hybrid analogues View at Publisher | View at Google Scholar

A Predictive Docking study of the interaction of some Benzenesulfinamides and Tetrafluorobenzenesulfinamides with Human Carbonic Anhydrase Isoforms I, IX and XII. View at Publisher | View at Google Scholar

EXPERIMENTAL AND QUANTUM-CHEMICAL RESEARCHES OF SOME SUBSTITUTED DERIVATIVES OF 1,8-DIOXODECAHYDROACRIDINES AS INHIBITORS OF CORROSION IN CORROSION View at Publisher | View at Google Scholar

Inhibition of Fenton reaction is a novel mechanism to explain the therapeutic effect of intra-articular injection of PRP in patients with chronic haemophilic synovitis View at Publisher | View at Google Scholar

PRP in wound healing applications View at Publisher | View at Google Scholar

Characteristics of L-PRP preparations for treating Achilles tendon rupture within the PATH-2 study View at Publisher | View at Google Scholar

CoMSIA and POM analyses of anti-malarial activity of synthetic prodiginines View at Publisher | View at Google Scholar

A Comparative Quantification in Cellularity of Bone Marrow Aspirated with two New Harvesting Devices, and The Non-equivalent Difference Between A Centrifugated Bone Marrow Concentrate And A Bone Marrow Aspirate As Biological Injectates, Using A Bi-Lateral Patient Model View at Publisher | View at Google Scholar

Autologous Platelet-Rich Plasma Efficacy in the Field of Regenerative Medicine: Product and Quality Control View at Publisher | View at Google Scholar

Tautomeric origin of dual effects of N1-nicotinoyl-3-(4?-hydroxy-3?-methyl phenyl)-5-[(sub)phenyl]-2-pyrazolines on bacterial and viral strains: POM analyses as new efficient bioinformatics platform to predict and optimize bioactivity of drugs View at Publisher | View at Google Scholar

Synthesis and pharmacophore modeling of novel quinazolines bearing a biologically active sulfonamide moiety View at Publisher | View at Google Scholar

Transcriptional analysis of mouse wounds grafted with human mesenchymal stem cells and platelets View at Publisher | View at Google Scholar

Computational POM and 3D-QSAR evaluation of experimental in vitro HIV-1-Integrase inhibition of amide-containing diketoacids View at Publisher | View at Google Scholar

Optimizing Platelet-Rich Plasma (PRP) Injections: A Narrative Review | Biologic Orthopedics Journal View at Publisher | View at Google Scholar

Density functional theory (DFT) as a powerful tool for designing new organic corrosion inhibitors. Part 1: An overview View at Publisher | View at Google Scholar

Electrochemical behavior of steel/acid interface: adsorption and inhibition effect of oligomeric aniline View at Publisher | View at Google Scholar

Inhibition of Steel Corrosion in Nitric Acid by Sulfur Containing Compounds View at Publisher | View at Google Scholar

Electrochemical Corrosion Behavior of Mild Steel in HCl and H2SO4 Solutions in Presence of Loquat Leaf Extract View at Publisher | View at Google Scholar

Spectroscopic Characterization of Red Onion Skin Tannin and Its use as Alternative Aluminium Corrosion Inhibitor in Hydrochloric Acid Solutions View at Publisher | View at Google Scholar

Proposing a new empirical adsorption isotherm known as Adejo-Ekwenchi isotherm View at Publisher | View at Google Scholar

Synthesis, inhibition effects and thermodynamic studies of novel substituted quinoline son the corrosion of mild steel in 1 M HCl solution View at Publisher | View at Google Scholar

Adsorption and inhibitive properties of seroquel drug for the corrosion of zinc in 0.1 M hydrochloric acid solution View at Publisher | View at Google Scholar

Cashew Nut Testa Tannin: Assessing its Effects on the Corrosion of Aluminium in HCl View at Publisher | View at Google Scholar

Imidazole derivative as novel effective inhibitor of mild steel corrosion in aqueous sulphuric acid View at Publisher | View at Google Scholar

Corrosion inhibition study of 2-(2, 4-dichlorophenyl) -6-Nitro-1, 4-dihydroquinoxaline for carbon steel in hydrochloric acid solution View at Publisher | View at Google Scholar

The Development of a Mathematical Model for the Prediction of Corrosion Rate Behaviour for Mild Steel in 0.5 M Sulphuric Acid View at Publisher | View at Google Scholar

Influence of Malus domestica and Caesalpinia bonducella Leaf Extracts on the Corrosion Behaviour of Mild Steel in H2SO4 Solution View at Publisher | View at Google Scholar

Intra-Articular Injection of Autologous Microfat and Platelet-Rich Plasma in the Treatment of Knee Osteoarthritis: A Double-Blind Randomized Comparative Study View at Publisher | View at Google Scholar

How to improve antifungal bioactivity: POM and DFT study of some chiral amides derivatives of diacetyl-L-tartaric acid and amines View at Publisher | View at Google Scholar

Temporomandibular joint biosupplementation using platelet concentrates: a narrative review View at Publisher | View at Google Scholar

Computational POM and DFT Evaluation of Experimental in-vitro Cancer Inhibition of Staurosporine-Ruthenium(II) Complexes: The Power Force of Organometallics in Drug Design View at Publisher | View at Google Scholar

Metronidazole derivatives as a new class of antiparasitic agents: synthesis, prediction of biological activity, and molecular properties View at Publisher | View at Google Scholar

A Retrospective Analysis of Characteristic Features of Responders and Impaired Patients to a Single Injection of Pure Platelet-Rich Plasma in Knee Osteoarthritis View at Publisher | View at Google Scholar

POM analyses for antimicrobial evaluation of thienopyrimidinones derivatives: a rapid method for drug design View at Publisher | View at Google Scholar

Platelet-Rich Plasma Applications for Achilles Tendon Repair: A Bridge between Biology and Surgery View at Publisher | View at Google Scholar

Red blood cells and their releasates compromise bone marrow-derived human mesenchymal stem/stromal cell survival in vitro View at Publisher | View at Google Scholar

OPTIMIZING PLATELET-RICH PLASMA (PRP) INJECTIONS: A NARRATIVE REVIEW View at Publisher | View at Google Scholar

Bone Marrow Aspirate Concentrate Is Equivalent to PRP for the Treatment of Knee OA at 1 Year: Letter to the Editor View at Publisher | View at Google Scholar

Office-Based Orthobiologic Procedures for Tendons View at Publisher | View at Google Scholar

Healing through the lens of immunothrombosis: Biology-inspired, evolution-tailored, and human-engineered biomimetic therapies View at Publisher | View at Google Scholar

New design to remove leukocytes from platelet-rich plasma (PRP) based on cell dimension rather than density View at Publisher | View at Google Scholar

Level of Evidence on Platelet-rich Plasma in Plastic Surgery View at Publisher | View at Google Scholar

Preparation Systems View at Publisher | View at Google Scholar

Utilisation des PRP en traumatologie sportive en 2019. Recommandations professionnelles de la Société française de traumatologie du sportUse of platelet-rich plasma in sports medicine in 2019. Guidelines from the French Society of Sports Traumatology View at Publisher | View at Google Scholar

Les plasmas riches en plaquettes dans les lésions myo-aponévrotiquesPlatelet-rich plasma in myo-aponevrotic lesions View at Publisher | View at Google Scholar

Crystallographic study, biological evaluation and DFT/POM/Docking analyses of pyrazole linked amide conjugates: Identification of antimicrobial and antitumor pharmacophore sites View at Publisher | View at Google Scholar

Synthesis and antimicrobial activity evaluation of some new 7-substituted quinolin-8-ol derivatives: POM analyses, docking, and identification of antibacterial pharmacophore sites View at Publisher | View at Google Scholar

A density functional study of the inhibition of microsomal prostaglandin E2 Synthase-1 by 2-aryl substituted quinazolin-4(3H)-one, pyrido[4,3-d] pyrimidin-4(3H)-one and pyrido[2,3-d]pyrimidin-4(3H)-one derivatives View at Publisher | View at Google Scholar

Toward understanding the inhibition of vesicular stomatitis virus replication in MDCK cells by 4-quinolinecarboxylic acid analogues: A density functional study View at Publisher | View at Google Scholar

A quantum chemical analysis of the relationships between electronic structure, PAK1 inhibition and MEK phosphorylation in a series of 2-arylamino-4-aryl-pyrimidines View at Publisher | View at Google Scholar

45 Years of the KPG Method: A Tribute to Federico Peradejordi View at Publisher | View at Google Scholar

Novel Fluorinated Imidazolium Ionic Liquids: Eco-friendly, Facile and Efficient Construction, Characterization, in vitro Anticancer Activity, Toxicity and in silico Analysis View at Publisher | View at Google Scholar

A Theoretical Study of the Relationships between Electronic Structure and Cytotoxicity of a group of N2 -alkylated Quaternary ?-Carbolines against nine Tumoral Cell Lines View at Publisher | View at Google Scholar

Synthesis and antimicrobial activity evaluation of some new 7-substituted quinolin-8-ol derivatives: POM analyses, docking, and identification of antibacterial pharmacophore sites View at Publisher | View at Google Scholar

A Short Note on the Relationships between Electronic Structure and SNitrosoglutathione Reductase Inhibition by 3-[1-(4-carbamoylphenyl)-5- phenyl-1H-pyrrol-2-yl]propanoic acids. View at Publisher | View at Google Scholar

Synthesis and antimicrobial activity evaluation of some new 7-substituted quinolin-8-ol derivatives: POM analyses, docking, and identification of antibacterial pharmacophore sites View at Publisher | View at Google Scholar

A note on the relationships between electronic structure and inhibition of Chikungunya virus replication by a group of [1,2,3]triazolo[4,5-d]pyrimidin7(6H)-one derivatives View at Publisher | View at Google Scholar

Synthesis and Characterization of Substituted Imidazole Derivatives with Potential Biological Effect // Synthesis and Characterization of Substituted Imidazole Derivatives with Potential Biological Effect View at Publisher | View at Google Scholar

A DFT Study of the Inhibition of the Papain-like Protease (PLpro) from the SARS Coronavirus by a Group of 4-Piperidinecarboxamide Derivatives View at Publisher | View at Google Scholar

A Quantum Chemical Analysis of the Inactivation Rate Constant of the BoNT/A LC Neurotoxin by some 1,4-Benzoquinone and 1,4-Naphthoquinone derivatives. View at Publisher | View at Google Scholar

A theoretical approach to the cytotoxicity of a series of ?-carbolinedithiocarbamate derivatives against prostatic cancer (DU-145), breast cancer (MCF-7), human lung adenocarcinoma (A549) and cervical cancer (HeLa) cell lines View at Publisher | View at Google Scholar

A theoretical analysis of the relationships between electronic structure and HIV-1 integrase inhibition and antiviral activity of a series of naphthyridinone derivatives View at Publisher | View at Google Scholar

A quantum-chemical and docking study of the inhibitory activity of a family of thienopyrimidine derivatives bearing a chromone moiety against mTOR Kinase View at Publisher | View at Google Scholar

A quantum-chemical analysis of the antiproliferative activity of N-3-benzimidazolephenylbisamide derivatives against MGC803, HT29, MKN45 and SW620 cancer cell lines View at Publisher | View at Google Scholar

Quantum-chemical and docking studies of 8-hydroxy-quinolines as inhibitors of the botulinum neurotoxin a light chain (BoNT/A LC) View at Publisher | View at Google Scholar

Computational POM and 3D-QSAR evaluation of experimental in vitro HIV-1-Integrase inhibition of amide-containing diketoacids View at Publisher | View at Google Scholar

A DFT Analysis of the Inhibition of Carbonic Anhydrase Isoforms I, II, IX and XII by a Series of Benzenesulfonamides and Tetrafluorobenzenesulfonamides View at Publisher | View at Google Scholar

The different modes of docking of a series of benzenesulfonamides and tetrafluorobenzenesulfonamides to the carbonic anhydrase isoform II View at Publisher | View at Google Scholar

De novo design and in-silico studies of novel 1-phenyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid derivatives as HIV-1 reverse transcriptase inhibitors View at Publisher | View at Google Scholar

Electronic structure and rat fundus serotonin receptor binding affinity of phenetylamines and indolealkylamines. View at Publisher | View at Google Scholar

A DFT Analysis of the Relationships between Electronic Structure and Human ?, ? and ? Opioid Receptor Binding Affinity in a series of Diphenethylamines View at Publisher | View at Google Scholar

A DFT analysis of the relationships between electronic structure and inhibition of aurora kinase A and epidermal growth factor receptor kinase by a set of N4 -phenyl substituted-7H-pyrrolo[2,3-d]pyrimidin-4-amines View at Publisher | View at Google Scholar

Prediction of Drug-Resistance Using Genotypic and Docking Analysis Among Anti-Retroviral Therapy Naïve and First-Line Treatment Failures in Salem, Tamil Nadu, India View at Publisher | View at Google Scholar

A DFT and Docking study of the relationships between electronic structure and 5-HT2B receptor binding affinity in N-benzylphenethylamines View at Publisher | View at Google Scholar

On the compatibility between formal QSAR results and docking results: the relationship between electronic structure and H5N1 (A/goose/Guangdong/SH7/2013) neuraminidase inhibition by some Tamiflu derivatives as an example View at Publisher | View at Google Scholar

DESIGNING DISULFIDE CYCLIC PEPTIDE AS FUSION INHIBITOR THAT TARGETS DENV ENVELOPE PROTEIN View at Publisher | View at Google Scholar

A Preliminary Formal Quantitative Structure-Activity Relationship Study of some 1,7-Bis- (amino alkyl)diazachrysene Derivatives as Inhibitors of Botulinum Neurotoxin Serotype A Light Chain and Three P. falciparum Malaria Strains. View at Publisher | View at Google Scholar

D-CENT-QSAR PROGRAM. V. 1.0. A Free Software to Generate the data for HighQuality QUANTITATIVE STRUCTUREACTIVITY RELATIONSHIPS View at Publisher | View at Google Scholar

ombining Molecular docking and POM approaches for Anti-inflammatory activity of some novel quinazoline derivatives View at Publisher | View at Google Scholar

CORRELATION BETWEEN THE ELECTRONIC STRUCTURE OF QUINAZOLINE DERIVATIVES AND THE ACTIVITY OF THE NTR1 RECEPTOR View at Publisher | View at Google Scholar

A quantum-chemical analysis of the relationships between electronic structure and cytotoxicity, GyrB inhibition, DNA supercoiling inhibition and antitubercular activity of a series of quinolineaminopiperidine hybrid analogues View at Publisher | View at Google Scholar

Virtual Screening of Phytochemical Compounds as Potential Inhibitors against HIV-1 Resistance to protease inhibitor View at Publisher | View at Google Scholar

A quantum chemical analysis of the inhibition of protein kinase A (PKA) and Rho-associated protein kinase-2 (ROCK2) by a series of urea-based molecules View at Publisher | View at Google Scholar

A Predictive Docking study of the interaction of some Benzenesulfinamides and Tetrafluorobenzenesulfinamides with Human Carbonic Anhydrase Isoforms I, IX and XII. View at Publisher | View at Google Scholar

The mechanism, the chemoselectivity and the regioselectivity of the 1-Benzyl-4-ethynyl-1H-[1,2,3]triazole and 1-Azidomethyl-4-tert-butyl-benzene in [3+2] cycloaddition reactions: a DFT study View at Publisher | View at Google Scholar

A DFT COMPUTATIONAL STUDY ON THE MOLECULAR MECHANISM OF REACTION BETWEEN METHYL 3-HYDROXY-3-METHYL-2 METHYLENE BUTANOATE AND (E)-N-METHYL-1-PHENYLETHAN-1-IMINE OXIDE View at Publisher | View at Google Scholar

A DFT STUDY OF THE MOLECULAR MECHANISM, STEREO, CHEMIO AND REGIOSELECTIVITY OF THE CYCLOADDITION REACTION BETWEEN PHENYLSULFONYLFURAN-2(5H)-ONE AND DIAZOMETHANE View at Publisher | View at Google Scholar

Theoretical investigation of the mechanism, stereoselectivity and regioselectivity of the epoxidation reaction of ?-himachalene: MEDT screening View at Publisher | View at Google Scholar

Research Journal of Pharmaceutical, Biological and Chemical Sciences View at Publisher | View at Google Scholar

Design, synthesis and molecular modeling of phenyl dihydropyridazinone derivatives as B-Raf inhibitors with anticancer activity View at Publisher | View at Google Scholar

Synthesis, PASS Prediction and Docking Studies of Anti-inflammatory Activity of Novel Series of 2, 6-Bis (P-Chlorobenzoyl) 3, 6-Diphenyl-4-Methylthiamorpholine 1, 1-Dioxide View at Publisher | View at Google Scholar

IN SILICO MOLECULAR DOCKING STUDIES OF MULTI?POTENTIAL COMPOUNDS ISOLATED FROM PREMNA SERRATIFOLIA L View at Publisher | View at Google Scholar

Influence of Malus domestica and Caesalpinia bonducella Leaf Extracts on the Corrosion Behaviour of Mild Steel in H2SO4 Solution View at Publisher | View at Google Scholar

Density Functional Theory (B3LYP/6-31G*) Study of Toxicity of Polychlorinated Dibenzofurans View at Publisher | View at Google Scholar

Modelling of some Schiff bases as anti-Salmonella typhi drugs: A QSAR approach View at Publisher | View at Google Scholar

International Journal of Life Sciences and Review (IJLSR) View at Publisher | View at Google Scholar

Mangifera indica Leave Extracts as Organic Inhibitors on the Corrosion of Zinc Sheet in 5 M H2SO4 Solution View at Publisher | View at Google Scholar

Novel 8-Hydroxyqionoline Derivatives as Effective Corrosion Inhibitors for Mild Steel in HCl Solution: Synthesis, Characterization, Gravimetric, Electrochemical, Surface Morphological and UVVisible Spectrometry View at Publisher | View at Google Scholar

Use of Seroquel as an Effective Corrosion Inhibitor for Low Carbon Steel in 1 M HCl View at Publisher | View at Google Scholar

Determination of chemical potential for carvedilol, atenolol and Propranolol diffusion through SDS micelle solution View at Publisher | View at Google Scholar

Rizatriptan Benzoate as Corrosion Inhibitor for Mild Steel in Acidic Corrosive Medium: Experimental and Theoretical Analysis View at Publisher | View at Google Scholar

Hydrogen Bond Studies in Interact 6-Mercaptopurine with its Receptor Hypoxanthine-Guanine Phosphoribosyltransferase View at Publisher | View at Google Scholar

Phytochemical and spectroanalytical characterizations of some plants extract as green corrosion inhibitors View at Publisher | View at Google Scholar

Investigation of Anticancer Drug Activity 5-Fluorouracil and Some Analog Derivatives by QSAR: Theoretical Study View at Publisher | View at Google Scholar

Green Inhibitor for Aluminium and Mild Steel in Acidic Media: A Case Study of Exudates of Eucalyptus Citriodora View at Publisher | View at Google Scholar

Computational studies of the corrosion inhibition potentials of some derivatives of 1H-Imidazo [4, 5-F] [1, 10] phenanthroline View at Publisher | View at Google Scholar

Anti-corrosion Properties of Ethanol Extract of Acacia senegalensis stem on AlSiFe/SiC Composite in Sulfuric Acid Medium View at Publisher | View at Google Scholar

QSAR Model for Prediction of some Non-Nucleoside inhibitors of Dengue virus serotype 4 NS5 Using GFA-MLR Approach View at Publisher | View at Google Scholar

Electrochemical and Theoretical Studies of Novel Quinoxaline Derivatives as Corrosion Inhibitor for Mild Steel in HCl Solution View at Publisher | View at Google Scholar

Insilico design of highly potent anti-salmonella typhi drug candidates from schiff bases View at Publisher | View at Google Scholar

In-silico approaches towards the profiling of some anti-dengue virus as potent inhibitors against dengue NS-5 receptor View at Publisher | View at Google Scholar

Sulphuric Acid Corrosion of Mild Steel in Leave Extracts of Cnidoscolus aconitifolius Plant View at Publisher | View at Google Scholar

Adsorption and Corrosion inhibition of Azadirachta indica Gum with Zn2+/Ni2+ cations on Mild Steel in 1 mol L-1 HCl View at Publisher | View at Google Scholar

Tilia leafs kao ekoloki inhibitor korozije za meki ?elik u vodenim rastvorima View at Publisher | View at Google Scholar

DENSITY FUNCTIONAL THEORY AND MOLECULAR DYNAMIC SIMULATION STUDIES ON THE CORROSION INHIBITION OF SOME THIOSEMICARBAZIDE DERIVATIVES ON ALUMINUM METAL View at Publisher | View at Google Scholar

Extracted of Fresh Olive Leaves for Corrosion Steel Inhibitor View at Publisher | View at Google Scholar

Experimental and Quantum Chemical Studies on the Corrosion Inhibition Potentials of Xylopia aethiopica extracts View at Publisher | View at Google Scholar

Behaviour of ortho-N-Glycoside as Green Corrosion Inhibitors for Tin in 0.5 M Citric Acid View at Publisher | View at Google Scholar

Dopamine-Dextran Conjugate for the Inhibition of Corrosion of Steel in Acidic Medium View at Publisher | View at Google Scholar

Corrosion Inhibition of Mild Steel and Copper in Acidic Media Using Some Lebanese Plant Extracts View at Publisher | View at Google Scholar

Medicago sativa EXTRACTS AS EFFECTIVE CORROSION INHIBITORS OF STAINLESS STEEL IN ACIDIC ENVIRONMENT View at Publisher | View at Google Scholar

Adsorption and Inhibitive Properties of Some Plant Extracts for the Corrosion of Steel in Acidic Solutions View at Publisher | View at Google Scholar

Sonchus Asper Leaves Extract as a Corrosion Inhibitor for Mild Steel in Hydrochloric Acid Medium View at Publisher | View at Google Scholar

Simulation of Galvanic Corrosion for Aluminum, Copper, Iron and Zinc at different pH and temperatures View at Publisher | View at Google Scholar

Molecular Docking studies on phytocompounds from the methanol leaf extract of Carica papaya against Envelope protein of dengue virus (type-2) View at Publisher | View at Google Scholar

Dengue Virus Disease: Current Updates on the use of Carica Papaya Leaf Extract as a Potential Herbal Medicine View at Publisher | View at Google Scholar

https://www.indianjournals.com/ijor.aspx?target=ijor:aar1&volume=8&issue=2&article=002 View at Publisher | View at Google Scholar

Pharmacological updates of Carica papaya L. in the management of dengue View at Publisher | View at Google Scholar

The Inhibitive Performance of some Lebanese plant Extracts for the Corrosion of some Metals in Acidic Solution View at Publisher | View at Google Scholar

Docking, synthesis and bioassay studies of imine derivatives as potential inhibitors for dengue NS2B/ NS3 serine protease View at Publisher | View at Google Scholar

EFFECTS OF CORROSION INHIBITOR ON THE PERFORMANCE OF MILD STEEL AND PRESTRESSING STEEL View at Publisher | View at Google Scholar

Carica papaya: comprehensive overview of the nutritional values, phytochemicals and pharmacological activities View at Publisher | View at Google Scholar

Value stream mapping method for development of a dynamic model of capacity utilization View at Publisher | View at Google Scholar

A Multi-Perspective Review on Dengue Research View at Publisher | View at Google Scholar

IN-SILICO DOCKING OF BIOACTIVE COMPOUNDS DERIVED FROM CASSIA AURICULATA FLOWER EXTRACT AGAINST NS2B-NS3 PROTEASE OF DENGUE VIRUS View at Publisher | View at Google Scholar

Docking, synthesis and bioassay studies of imine derivatives as potential inhibitors for dengue NS2B/ NS3 serine View at Publisher | View at Google Scholar

Evaluation of the Inhibitors Effect of Some Plant Extracts on the Corrosion of Mild Steel in Acidic Media View at Publisher | View at Google Scholar

The effectiveness of papaya leaf extract fraction (Carica papaya L.) as dengue antiviral in vitro View at Publisher | View at Google Scholar

Innovative Formulation for Control of Scale Deposition and Corrosion in Industrial Cooling Water Systems View at Publisher | View at Google Scholar

Computational Modeling: Theoretical Predictive Tools for Designing of Potential Organic Corrosion Inhibitors View at Publisher | View at Google Scholar

Experimental studies of indoloimidazole derivative as corrosion inhibitor on mild steel in acidic media View at Publisher | View at Google Scholar

On novel harmonic indices of certain nanotubes View at Publisher | View at Google Scholar

Calculating Some Topological Indices of SiO2 Layer Structure View at Publisher | View at Google Scholar

Corrosion protection of soft-cast steel in 1 M HCl with Araucaria heterophylla leaves extract View at Publisher | View at Google Scholar

COMPUTATION OF SOME NEW/OLD VERTEX-DEGREE-BASED TOPOLOGICAL INDICES OF LINE GRAPH OF SUBDIVISION GRAPH OF SOME NANOSTRUCTURES View at Publisher | View at Google Scholar

The Harmonic Polynomial and Harmonic Index of Certain Carbon Nanotubes View at Publisher | View at Google Scholar

In vitro polyploidy induction: changes in morphological, anatomical and phytochemical characteristics of Thymus persicus View at Publisher | View at Google Scholar

Integrating GUSAR and QSAR analyses for antimalarial activity of synthetic prodiginines against multi drug resistant strain View at Publisher | View at Google Scholar

QSAR Models for Anti-Malarial Activity of 4-Aminoquinolines View at Publisher | View at Google Scholar

Optimization of antiproliferative activity of substituted phenyl 4-(2-oxoimidazolidin-1-yl) benzenesulfonates: QSAR and CoMFA analyses View at Publisher | View at Google Scholar

Computational POM and 3D-QSAR evaluation of experimental in vitro HIV-1-Integrase inhibition of amide-containing diketoacids View at Publisher | View at Google Scholar

Screening of commercial cyclic peptide conjugated to HIV-1 Tat peptide as inhibitor of N-terminal heptad repeat glycoprotein-2 ectodomain Ebola virus through in silico analysis View at Publisher | View at Google Scholar

k-NN, quantum mechanical and field similarity based analysis of xanthone derivatives as ?-glucosidase inhibitors View at Publisher | View at Google Scholar

Anticonvulsant and depressant-like activity of ursolic acid stearoyl glucoside isolated from Lantana camara L. (verbanaceae) View at Publisher | View at Google Scholar

Virtual screening of Indonesian flavonoid as neuraminidase inhibitor of influenza a subtype H5N1 View at Publisher | View at Google Scholar

Oxidation and Acetylation of Ursolic and Oleanolic Acids Isolated from Fragraea fragrans fruits; Antiproliferation of P388 Leukemia Cells View at Publisher | View at Google Scholar

Structural characterization of new pentacyclic triterpenoids View at Publisher | View at Google Scholar

Novel Ursolic Acid Loaded Proniosomal Gel And Method Of Preparation Thereof View at Publisher | View at Google Scholar

MOLECULAR MODELING STUDY OF VARIOUS SYNTHETIC JHAS CONTAINING VARIED FUNCTIONALITY View at Publisher | View at Google Scholar

Drug Design and Analysis In Silico of Sapelenin G, an Acyclic Triterpenoid as Potential Anti-Inflammatory View at Publisher | View at Google Scholar

Screening of Commercial Cyclic Peptide Conjugated to HIV-1 Tat Peptide as Inhibitor of N-Terminal Heptad Repeat Glycoprotein-2 Ectodomain Ebola Virus Through In Silico Analysis View at Publisher | View at Google Scholar

Integrating GUSAR and QSAR analyses for antimalarial activity of synthetic prodiginines against multi drug resistant strain View at Publisher | View at Google Scholar

Ursolic Acid: 5 cyclic triterpenoid in apple peel With a wide range of therapeutic effects View at Publisher | View at Google Scholar

Molecular interaction study of commercial cyclic peptides and MERS-COV papain-like protease as novel drug candidate for MERS-COV View at Publisher | View at Google Scholar

Ursolic Acid: 5 cyclic triterpenoid in apple peel With a wide range of therapeutic effects View at Publisher | View at Google Scholar

Some remarks on the interpretation of the local atomic reactivity indices within the Klopman Peradejordi Gomez (KPG) method. I. Theoretical analysis View at Publisher | View at Google Scholar

A Density Functional Theory Analysis of the relationships between electronic structure and KCNQ2 potassium channels inhibition by a series of retigabine derivatives View at Publisher | View at Google Scholar

Some remarks about the relationships between the common skeleton concept within the Klopman-Peradejordi-Gómez QSAR method and the weak molecule-site interactions View at Publisher | View at Google Scholar

A Quantum-chemical study of the relationships between electronic structure and affinities for the serotonin transporter protein and the 5-HT1A receptor in a series of 2H-pyrido[1,2-c]pyrimidine derivatives View at Publisher | View at Google Scholar

Quantum Chemical Study of the Relationships between Electronic Structure and Corticotropin-Releasing Factor 1 Receptor Binding Inhibition by a Group of Benzazole Derivatives View at Publisher | View at Google Scholar

A DFT study or the relationship between the electronic structure and the antiplasmodial activity of a series of 4-anilino-2-trichloromethylquinazolines derivatives View at Publisher | View at Google Scholar

The relationships between electronic structure and human A1 adenosine receptor binding affinity in a series of triazolopyridine derivatives View at Publisher | View at Google Scholar

A Theoretical Analysis of the Relationships between Electronic Structure and Dopamine D4 Receptor Affinity in a series of compounds based on the classical D4 agonist A-412997 View at Publisher | View at Google Scholar

A DFT Investigation of the Relationships between Electronic Structure and D2, 5-HT1A, 5-HT2A, 5-HT6 and 5-HT7 Receptor Affinities in a group of Fananserin derivatives View at Publisher | View at Google Scholar

A DFT study of the relationships between electronic structure and dopamine D1 and D2 receptor affinity of a group of (S)-enantiomers of 11-(1,6-dimethyl1,2,3,6-tetrahydropyridin-4-yl)-5H-dibenzo[b,e][1,4]diazepines View at Publisher | View at Google Scholar

A Note on the Binding of N-2-Methoxybenzyl-phenethylamines (NBOMe Drugs) to the 5- HT2C Receptors View at Publisher | View at Google Scholar

Dissecting the Drug-receptor Interaction with the Klopman-Peradejordi-Gómez (KPG) Method-II: The Interaction of 2,5-Dimethoxyphenethylamines and their N-2- methoxybenzyl-substituted Analogs with 5-HT2A Serotonin Receptors View at Publisher | View at Google Scholar

A quantum-chemical analysis of the relationships between electronic structure and inhibition of SARS-CoV-2 virus by a group of cyclic sulfonamide derivatives View at Publisher | View at Google Scholar

A Quantum-Chemical Study of the Relationships between Electronic Structure and AntiProliferative Activities of Quinoxaline Derivatives on the K562 and MCF-7 Cell Lines View at Publisher | View at Google Scholar

PHYSICS CARTOONS: SCHRÖDINGER'S CAT View at Publisher | View at Google Scholar

The Rationale of Autologously Prepared Bone Marrow Aspirate Concentrate for use in Regenerative Medicine Applications View at Publisher | View at Google Scholar

Isolation, Activation, and Mechanism of Action of Platelet-Rich Plasma and Its Applications for Joint Repair View at Publisher | View at Google Scholar

Quantum Chemical Study of the Relationships between Electronic Structure and Antiviral Activities against Influenza A H1N1, Enterovirus 71 and Coxsackie B3 viruses of some Pyrazine-1,3-thiazine Hybrid Analogues View at Publisher | View at Google Scholar

General Unrestricted Structure Activity Relationships based evaluation of quinoxaline derivatives as potential influenza NS1A protein inhibitors View at Publisher | View at Google Scholar

Molecular docking and 3D QSAR studies of quinoxaline derivatives as potential influenza NS1A protein inhibitors View at Publisher | View at Google Scholar

Exploring interactions of 2-Amino-6-arylsulfonylbenzonitrile derivatives as non-nucleoside reverse transcriptase inhibitors of HIV-1 using docking studies. View at Publisher | View at Google Scholar

Searching of flavonoid compounds as a new antiviral for Sudan Ebolavirus glycoprotein using in silico methods View at Publisher | View at Google Scholar

Computational POM and 3D-QSAR evaluation of experimental in vitro HIV-1-Integrase inhibition of amide-containing diketoacids View at Publisher | View at Google Scholar

A Quantum-chemical Study of the Relationships Between Electronic Structure and Anti-proliferative Activity of Quinoxaline Derivatives on the HeLa Cell Line View at Publisher | View at Google Scholar

COMPUTING SANSKRUTI INDEX OF TURC4C8(S) NANOTUBE View at Publisher | View at Google Scholar

Chemical and Electrochemical Studies of Novel Quinazolinone Derivatives based on 8-hydroxyquinoline as Corrosion Inhibitor for Mild Steel in 1.0 M HCl Solution View at Publisher | View at Google Scholar

Inhibitive behaviour of Acacia senegalensis on corrosion resistance of mild steel-acidic environment View at Publisher | View at Google Scholar

The inhibition effect of [3-(4-hydroxy-3-methoxy-phenyl)-1-(2-hydroxyphenyl-propenone)] on the corrosion of the aluminium in alkaline medium View at Publisher | View at Google Scholar

Tilia leafs kao ekoloki inhibitor korozije za meki ?elik u vodenim rastvorima View at Publisher | View at Google Scholar

Inhibition of Steel Corrosion in Industrial Acid Cleaning Systems Using Organic Compounds View at Publisher | View at Google Scholar

Caffeine-A Potential Corrosion Inhibiter for Metals in Acidic Media View at Publisher | View at Google Scholar

Assessment of Locust Bean Pod Extract (Parkia Biglobosa) as Corrosion Inhibitor for Mild Steel in Acidic Media View at Publisher | View at Google Scholar

Journal total citations count	890
Journal impact factor	1.96
Journal 5 years impact factor	2.21
Journal cite score	2.22
Journal h-index	10

Scholars Research Library

Journal of Computational Methods in Molecular Design

Citations Report

Journal of Computational Methods in Molecular Design : Citations & Metrics Report

Google Scholar citation report

Citations : 890

Indexed In