On the public citation graph

Spectrochemical, Antimicrobial and Pharmacological Studies of Some Arylidene-Malononitrile and Ethyl-2-Cyano-3-Phenylacrylate Derivatives

https://doi.org/10.2139/ssrn.4826459
0 signed · 64 inferred · view as graph

Inferred edges come from two machine sources: sweeps of open repository metadata (mostly SSRN and Zenodo), and a bulk OpenAlex citation snapshot. Every row below is labelled with the one it came from. Neither is a complete citation index — absence here is not evidence of absence.

Is this your work? Sign in with ORCID and put your name on the claims that are yours.
Claim with ORCID
Reference health. See whether every reference in this work resolves to a known work and none has been retracted — and get a dated CiteStamped badge you can embed.
See reference health

What this work says

Outgoing claims: the papers this work cites, builds on, or argues with.

inferredcites →https://doi.org/10.1002/1521-3838(200012)19:6<599::aid-qsar599>3.0.co;2-bopenalex-extracted
BuildQSAR: A New Computer Program for QSAR Analysis
inferredcites →https://doi.org/10.1002/cctc.202200696openalex-extracted
Is a Catalyst Always Needed? The Case of the Knoevenagel Reaction with Malononitrile
inferredcites →https://doi.org/10.1002/chin.200427290openalex-extracted
Molecular Electrostatic Potentials
inferredcites →https://doi.org/10.1002/minf.201000118openalex-extracted
In Silico Prediction of Caco‐2 Cell Permeability by a Classification QSAR Approach
inferredcites →https://doi.org/10.1002/minf.201000151openalex-extracted
QSAR Modelling of Rat Acute Toxicity on the Basis of PASS Prediction
inferredcites →https://doi.org/10.1002/slct.202001442openalex-extracted
Ultrasound‐Assisted Synthesis of Nitrogen and Oxygen Containing Heterocycles Using Fluorinated Graphene Oxide as Catalyst: Evaluation of Their Anthelmintic Activities
inferredcites →https://doi.org/10.1002/wcms.8openalex-extracted
Noncovalent interactions in biochemistry
inferredcites →https://doi.org/10.1007/s002140000204openalex-extracted
Harmonic frequency scaling factors for Hartree-Fock, S-VWN, B-LYP, B3-LYP, B3-PW91 and MP2 with the Sadlej pVTZ electric property basis set
inferredcites →https://doi.org/10.1007/s12039-019-1641-6openalex-extracted
Clean synthesis of benzylidenemalononitrile by Knoevenagel condensation of benzaldehyde and malononitrile: effect of combustion fuel on activity and selectivity of Ti-hydrotalcite and Zn-hydrotalcite catalysts
inferredcites →https://doi.org/10.1016/b978-0-12-809633-8.20197-0openalex-extracted
Quantitative Structure-Activity Relationship (QSAR): Modeling Approaches to Biological Applications
inferredcites →https://doi.org/10.1016/j.bcp.2011.05.028openalex-extracted
Benzylidenemalononitrile compounds as activators of cell resistance to oxidative stress and modulators of multiple signaling pathways. A structure–activity relationship study
inferredcites →https://doi.org/10.1016/j.bmcl.2007.06.071openalex-extracted
PASS-predicted design, synthesis and biological evaluation of cyclic nitrones as nootropics
inferredcites →https://doi.org/10.1016/j.bpc.2020.106443openalex-extracted
Silica bonded N-(propylcarbamoyl)sulfamic acid (SBPCSA) as a highly efficient and recyclable solid catalyst for the synthesis of Benzylidene Acrylate derivatives: Docking and reverse docking integrated approach of network pharmacology
inferredcites →https://doi.org/10.1016/j.cbpa.2004.06.005openalex-extracted
Predictive ADMET studies, the challenges and the opportunities
inferredcites →https://doi.org/10.1016/j.drudis.2019.03.015openalex-extracted
ADMET modeling approaches in drug discovery
inferredcites →https://doi.org/10.1016/j.drudis.2020.07.017openalex-extracted
Fsp3: A new parameter for drug-likeness
inferredcites →https://doi.org/10.1016/j.heliyon.2021.e07509openalex-extracted
The effect of alkyl chain and electronegative atoms in anion on biological activity of anilinium carboxylate bioactive ionic liquids and computational approaches by DFT functional and molecular docking
inferredcites →https://doi.org/10.1016/j.imu.2021.100677openalex-extracted
Structure-based design of new diclofenac: Physicochemical, spectral, molecular docking, dynamics simulation and ADMET studies
inferredcites →https://doi.org/10.1016/j.imu.2021.100706openalex-extracted
Physicochemical, spectral, molecular docking and ADMET studies of Bisphenol analogues; A computational approach
inferredcites →https://doi.org/10.1016/j.imu.2023.101159openalex-extracted
Selective modification of diclofenac to reduce the adverse effects; A computer-aided drug design approach
inferredcites →https://doi.org/10.1016/j.imu.2023.101254openalex-extracted
Spectrochemical, biological, and toxicological studies of DDT, DDD, and DDE: An in-silico approach
inferredcites →https://doi.org/10.1016/j.jmgm.2006.02.009openalex-extracted
Fast empirical pKa prediction by Ewald summation
inferredcites →https://doi.org/10.1016/j.molstruc.2019.05.102openalex-extracted
Synthesis, characterization, ADMET, PASS predication, and antimicrobial study of 6-O-lauroyl mannopyranosides
inferredcites →https://doi.org/10.1016/j.molstruc.2021.130498openalex-extracted
Enzymes inhibition profiles and antibacterial activities of benzylidenemalononitrile derivatives
inferredcites →https://doi.org/10.1016/j.saa.2013.10.042openalex-extracted
Quantum chemical studies, natural bond orbital analysis and thermodynamic function of 2,5-dichlorophenylisocyanate
inferredcites →https://doi.org/10.1021/cc9800071openalex-extracted
A Knowledge-Based Approach in Designing Combinatorial or Medicinal Chemistry Libraries for Drug Discovery. 1. A Qualitative and Quantitative Characterization of Known Drug Databases
inferredcites →https://doi.org/10.1021/ci300213copenalex-extracted
xPyder: A PyMOL Plugin To Analyze Coupled Residues and Their Networks in Protein Structures.
inferredcites →https://doi.org/10.1021/ci300367aopenalex-extracted
admetSAR: A Comprehensive Source and Free Tool for Assessment of Chemical ADMET Properties
inferredcites →https://doi.org/10.1021/cr00022a002openalex-extracted
The chemistry of .beta.-enaminonitriles as versatile reagents in heterocyclic synthesis
inferredcites →https://doi.org/10.1021/cr200176ropenalex-extracted
Multiple Binding Modes of Inhibitors to Carbonic Anhydrases: How to Design Specific Drugs Targeting 15 Different Isoforms?
inferredcites →https://doi.org/10.1021/cr60261a001openalex-extracted
Chemistry of malononitrile
inferredcites →https://doi.org/10.1021/ja983494xopenalex-extracted
Electrophilicity Index
inferredcites →https://doi.org/10.1021/ja9924039openalex-extracted
Variational Principles for Describing Chemical Reactions: The Fukui Function and Chemical Hardness Revisited
inferredcites →https://doi.org/10.1021/jm000292eopenalex-extracted
Prediction of Drug Absorption Using Multivariate Statistics
inferredcites →https://doi.org/10.1021/jm015507eopenalex-extracted
Simple Selection Criteria for Drug-like Chemical Matter
inferredcites →https://doi.org/10.1021/jm020017nopenalex-extracted
Molecular Properties That Influence the Oral Bioavailability of Drug Candidates
inferredcites →https://doi.org/10.1021/jp045733aopenalex-extracted
New Scale Factors for Harmonic Vibrational Frequencies Using the B3LYP Density Functional Method with the Triple-ζ Basis Set 6-311+G(d,p)
inferredcites →https://doi.org/10.1021/jp990092iopenalex-extracted
Reduced HOMO−LUMO Gap as an Index of Kinetic Stability for Polycyclic Aromatic Hydrocarbons
inferredcites →https://doi.org/10.1021/tx900189popenalex-extracted
Quantitative Structure−Activity Relationship Modeling of Rat Acute Toxicity by Oral Exposure
inferredcites →https://doi.org/10.1038/nchem.1243openalex-extracted
Quantifying the chemical beauty of drugs
inferredcites →https://doi.org/10.1038/newbio240226a0openalex-extracted
Association of Arginine-rich Histones with G·C-rich Regions of DNA in Chromatin
inferredcites →https://doi.org/10.1038/nprot.2007.303openalex-extracted
Determination of drug permeability and prediction of drug absorption in Caco-2 monolayers
inferredcites →https://doi.org/10.1039/d0md00366bopenalex-extracted
The modulatory role of sulfated and non-sulfated small molecule heparan sulfate-glycomimetics in endothelial dysfunction: absolute structural clarification, molecular docking and simulated dynamics, SAR analyses and ADMET studies
inferredcites →https://doi.org/10.1063/1.4872239openalex-extracted
Structure and dynamics of TIP3P, TIP4P, and TIP5P water near smooth and atomistic walls of different hydroaffinity
inferredcites →https://doi.org/10.1074/jbc.m116.743138openalex-extracted
The Human Ether-a-go-go-related Gene (hERG) Potassium Channel Represents an Unusual Target for Protease-mediated Damage
inferredcites →https://doi.org/10.1080/00397910600640289openalex-extracted
Efficient Green Procedure for the Knoevenagel Condensation under Solvent‐Free Conditions
inferredcites →https://doi.org/10.1080/08927022.2020.1811866openalex-extracted
Synthesis of 5, 6-diaroylisoindoline-1, 3-dione and computational approaches for investigation on structural and mechanistic insights by DFT
inferredcites →https://doi.org/10.1093/bioinformatics/16.8.747openalex-extracted
PASS: prediction of activity spectra for biologically active substances
inferredcites →https://doi.org/10.1093/bioinformatics/btr497openalex-extracted
iMod: multipurpose normal mode analysis in internal coordinates
inferredcites →https://doi.org/10.1098/rsos.140160openalex-extracted
Potency of irritation by benzylidenemalononitriles in humans correlates with TRPA1 ion channel activation
inferredcites →https://doi.org/10.1098/rsos.202056openalex-extracted
Facile fabrication of polymer network using click chemistry and their computational study
inferredcites →https://doi.org/10.1103/physrevlett.76.1212openalex-extracted
Excitation Energies from Time-Dependent Density-Functional Theory
inferredcites →https://doi.org/10.1111/j.1365-2036.2007.03307.xopenalex-extracted
Review article: drug hepatotoxicity
inferredcites →https://doi.org/10.1186/s13321-015-0109-zopenalex-extracted
ChemDes: an integrated web-based platform for molecular descriptor and fingerprint computation
inferredcites →https://doi.org/10.1186/s13756-020-00872-wopenalex-extracted
Economic burden of antibiotic resistance in China: a national level estimate for inpatients
inferredcites →https://doi.org/10.1186/s43088-021-00117-8openalex-extracted
Investigating the binding affinity, molecular dynamics, and ADMET properties of 2,3-dihydrobenzofuran derivatives as an inhibitor of fungi, bacteria, and virus protein
inferredcites →https://doi.org/10.1517/13543776.2012.707646openalex-extracted
Update on carbonic anhydrase inhibitors: a patent review (2008 – 2011)
inferredcites →https://doi.org/10.1517/17460441.2012.666235openalex-extracted
Thermodynamic studies for drug design and screening
inferredcites →https://doi.org/10.18773/austprescr.2014.050openalex-extracted
P-glycoprotein and its role in drug-drug interactions
inferredcites →https://doi.org/10.2174/156802610790232260openalex-extracted
3D-QSAR in Drug Design - A Review
inferredcites →https://doi.org/10.3390/ijms20184574openalex-extracted
Key Topics in Molecular Docking for Drug Design
inferredcites →https://doi.org/10.52763/pjsir.phys.sci.56.3.2013.131.137openalex-extracted
Microwave Assisted Knoevenagel Condensation: Synthesis and Antimicrobial Activities of Some a-Cyanoacrylates
inferredcites →https://doi.org/10.5530/pj.2022.14.204openalex-extracted
DFT and Pharmacokinetic Study of Some Heterocyclic Aspirin Derivatives as The Cyclooxygenase Inhibitors: An In-Silico Approach
inferredcites →https://doi.org/10.5530/pj.2023.15.29openalex-extracted
Computational and Pharmacokinetic Investigation of Some Heterocyclic Amide Derivatives as Cyclooxygenase Inhibitors: An In-Silico Approach
Editorial review for independent work. ICSAC — the Institute for Complexity Science and Advanced Computing — runs a structured editorial panel for researchers publishing outside journals, and publishes on CiteStamp rails. Submission is free and goes through ORCID: icsacinstitute.org/submit.