An Update on Molecularly Imprinted Polymer Design through a Computational Approach to Produce Molecular Recognition Material with Enhanced Analytical Performance

Preparation and application of simetryn‐imprinted nanoparticles in triazine herbicide residue analysis

(2020) Zhenhao Tong et al.   JOURNAL OF SEPARATION SCIENCE

Computational design of synthetic receptors for drug detection: interaction between molecularly imprinted polymers and MDMA (3,4-methylenedioxymethamphetamine)

(2020) T. A. Sales et al.   THEORETICAL CHEMISTRY ACCOUNTS

Synthesis of Diazepam-Imprinted Polymers with Two Functional Monomers in Chloroform Using a Bulk Polymerization Method

(2020) Aliya Nur Hasanah et al.   Journal of Chemistry

The molecular imprinting effect of propranolol and dibenzylamine as model templates: Binding strength and selectivity

(2020) Anett Nagy-Szakolczai et al.   ANALYTICA CHIMICA ACTA

Computational aided acetaminophen – phthalic acid molecularly imprinted polymer design for analytical determination of known and new developed recreational drugs

(2020) M. Paredes-Ramos et al.   JOURNAL OF MOLECULAR GRAPHICS & MODELLING

Synthesis, characterization and application of a novel ion hybrid imprinted polymer to adsorb Cd(II) in different samples

(2020) Anais Adauto et al.   ENVIRONMENTAL RESEARCH

Theoretical Insight into the Interaction between Chloramphenicol and Functional Monomer (Methacrylic Acid) in Molecularly Imprinted Polymers

(2020) Lei Xie et al.   INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES

Rational design and synthesis of molecularly imprinted polymers (MIP) for purifying tylosin by seeded precipitation polymerization

(2020) Hainan Zeng et al.   PROCESS BIOCHEMISTRY

Molecularly imprinted polymers for selective extraction of rosmarinic acid from Rosmarinus officinalis L.

(2020) Engy M. Saad et al.   FOOD CHEMISTRY

Molecular structure and spectral characteristics of hyperoside and analysis of its molecular imprinting adsorption properties based on density functional theory

(2019) Jun Liu et al.   JOURNAL OF MOLECULAR GRAPHICS & MODELLING

Synthesis and application of a molecularly imprinted polymer in selective solid-phase extraction of efavirenz from water

(2019) Sinothando P. Mtolo et al.   WATER SCIENCE AND TECHNOLOGY

Toward Rational Design of Selective Molecularly Imprinted Polymers (MIPs) for Proteins: Computational and Experimental Studies of Acrylamide Based Polymers for Myoglobin

(2019) Mark V. Sullivan et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Computational design of molecularly imprinted polymer for solid phase extraction of moxifloxacin hydrochloride from Avalox® tablets and spiked human urine samples

(2019) Mennatallah A. Hammam et al.   MICROCHEMICAL JOURNAL

Computational approximations of molecularly imprinted polymers with sulphur based monomers for biological purposes

(2019) M. Paredes-Ramos et al.   Materials Today Communications

Preparation, evaluation and application of core–shell molecularly imprinted particles as the sorbent in solid-phase extraction and analysis of lincomycin residue in pasteurized milk

(2019) Mohammad Negarian et al.   FOOD CHEMISTRY

Computational design of a molecularly imprinted polymer compatible with an aqueous environment for solid phase extraction of chenodeoxycholic acid

(2019) Xue Yu et al.   JOURNAL OF CHROMATOGRAPHY A

Development of biomimetic enzyme-linked immunosorbent assay based on molecular imprinting technique for semicarbazide detection

(2019) Wenlong Yu et al.   FOOD AND AGRICULTURAL IMMUNOLOGY

Theoretical design, preparation, and evaluation of Ginkgolide B molecularly imprinted polymers

(2019) Honghong Li et al.   JOURNAL OF SEPARATION SCIENCE

An Investigation of the Intermolecular Interactions and Recognition Properties of Molecular Imprinted Polymers for Deltamethrin through Computational Strategies

(2019) Lei Xie et al.   Polymers

Theoretical Design and Adsorption Properties of Molecularly Imprinted Polymers Obtained from Chloramphenicol and Acrylamide

(2019) Junbo Liu et al.   CHEMICAL RESEARCH IN CHINESE UNIVERSITIES

Retention and molecular-recognition mechanisms of molecularly imprinted polymers for promazine derivatives

(2019) Jun Haginaka et al.   TALANTA

Rational design of a molecularly imprinted polymer for dinotefuran: theoretical and experimental studies aimed at the development of an efficient adsorbent for microextraction by packed sorbent

(2018) Camilla Fonseca Silva et al.   ANALYST

Applying molecular modelling and experimental studies to develop molecularly imprinted polymer for domoic acid enrichment from both seawater and shellfish

(2018) Junjie Ao et al.   CHEMOSPHERE

Magnetic molecularly imprinted polymer nanoparticles for simultaneous extraction and determination of 6-mercaptopurine and its active metabolite thioguanine in human plasma

(2018) Olivia A. Attallah et al.   JOURNAL OF CHROMATOGRAPHY A

Quantum mechanical studies on dioxin-imprinted polymer precursor composites: Fundamental insights to enhance the binding strength and selectivity of biomarkers

(2018) Muntazir S. Khan et al.   JOURNAL OF MOLECULAR RECOGNITION

Applications of molecularly imprinted polymers for solid-phase extraction of non-steroidal anti-inflammatory drugs and analgesics from environmental waters and biological samples

(2018) Lawrence Mzukisi Madikizela et al.   JOURNAL OF PHARMACEUTICAL AND BIOMEDICAL ANALYSIS

Isolation of sinapic acid from broccoli using molecularly imprinted polymers

(2018) Heba Hosny et al.   JOURNAL OF SEPARATION SCIENCE

Magnetic Porous Molecularly Imprinted Polymers Based on Surface Precipitation Polymerization and Mesoporous SiO2 Layer as Sacrificial Support for Efficient and Selective Extraction and Determination of Chlorogenic Acid in Duzhong Brick Tea

(2018) Mijun Peng et al.   MOLECULES

Selective extraction of organophosphorous pesticides in plasma by magnetic molecularly imprinted polymers with the aid of computational design

(2018) Mohammad Mehdipour et al.   Analytical Methods

Molecularly imprinted solid phase extraction coupled with gas chromatography-mass spectrometry for determination of N-Nitrosodiphenylamine in water samples

(2018) Zhigang Li et al.   CHEMOSPHERE

Application of molecularly imprinted polymer designed for the selective extraction of ketoprofen from wastewater

(2018) Lawrence Mzukisi Madikizela et al.   WATER SA

A novel surface plasmon resonance sensor based on a functionalized graphene oxide/molecular-imprinted polymer composite for chiral recognition of l-tryptophan

(2018) Xiaoyan Xu et al.   RSC Advances

Morphine Sensing by a Green Modified Molecularly Imprinted Poly L-Lysine/Sodium Alginate−Activated Carbon/Glassy Carbon Electrode Based on Computational Design

(2018) Maryam Salajegheh et al.   ELECTROANALYSIS

A computational and experimental approach to develop minocycline-imprinted hydrogels and determination of their drug delivery performances

(2018) Büsra Eroglu et al.   JOURNAL OF POLYMER RESEARCH

Synthesis and Characterization of a Molecularly Imprinted Polymer of Spermidine and the Exploration of Its Molecular Recognition Properties

(2018) Yu-Jie Huang et al.   Polymers

Computer-Aided Design of Molecularly Imprinted Polymers for Simultaneous Detection of Clenbuterol and Its Metabolites

(2018) Bingcheng Zhang et al.   Polymers

Carvedilol-Imprinted Polymer: Rational design and selectivity studies

(2018) Thales F.D. Pereira et al.   JOURNAL OF MOLECULAR STRUCTURE

Computation-Assisted Molecularly Imprinted Polymer Synthesis for Extraction of Naltrexone from Urine Using Experimental Design and Determination by UPLC–DAD

(2017) Mahdiyeh Ebrahimi Rahmani et al.   JOURNAL OF AOAC INTERNATIONAL

Development of a molecularly imprinted polymer for a pharmaceutical impurity in supercritical CO 2 : Rational design using computational approach

(2017) R. Viveiros et al.   JOURNAL OF CLEANER PRODUCTION

Theoretical guidance for experimental research of the dicyandiamide and methacrylic acid molecular imprinted polymer

(2017) Junbo Liu et al.   NEW JOURNAL OF CHEMISTRY

A comprehensive theoretical study of structural optimization, interaction energies calculations and solvent effects between ractopamine and functional monomers in molecular imprinting polymers

(2017) Haiyan Wu et al.   POLYMER BULLETIN

Theoretical and experimental studies of ion imprinted polymer for nitrate detection

(2017) Noorhidayah Ishak et al.   POLYMER SCIENCE SERIES A

Computational approaches in the design of synthetic receptors – A review

(2016) Todd Cowen et al.   ANALYTICA CHIMICA ACTA

Oxytetracycline recovery from aqueous media using computationally designed molecularly imprinted polymers

(2016) Rosalía Rodríguez-Dorado et al.   ANALYTICAL AND BIOANALYTICAL CHEMISTRY

Molecularly imprinted polymers for separating and sensing of macromolecular compounds and microorganisms

(2016) Zofia Iskierko et al.   BIOTECHNOLOGY ADVANCES

Development of imprinted polyneutral red/electrochemically reduced graphene oxide composite for ultra-trace sensing of 6-thioguanine

(2016) Bhim Bali Prasad et al.   CARBON

Towards EMIC rational design: setting the molecular simulation toolbox for enantiopure molecularly imprinted catalysts

(2016) Tessa Jalink et al.   Chemistry Central Journal

Water-compatible imprinted pills for sensitive determination of cannabinoids in urine and oral fluid

(2016) M. Concepción Cela-Pérez et al.   JOURNAL OF CHROMATOGRAPHY A

Modeling prepolymerization step of a serotonin imprinted polymer

(2016) Ersin Gündeğer et al.   JOURNAL OF MOLECULAR MODELING

New sorbent materials for selective extraction of cocaine and benzoylecgonine from human urine samples

(2016) Renata Bujak et al.   JOURNAL OF PHARMACEUTICAL AND BIOMEDICAL ANALYSIS

Design of a New Molecularly Imprinted Polymer Selective for Hydrochlorothiazide Based on Theoretical Predictions Using Gibbs Free Energy

(2016) Leonardo A. Barros et al.   JOURNAL OF THE BRAZILIAN CHEMICAL SOCIETY

Computationally modelled receptors for drug monitoring using an optical based biomimetic SPR sensor

(2016) Zeynep Altintas et al.   SENSORS AND ACTUATORS B-CHEMICAL

Selective determination of cocaine and its metabolite benzoylecgonine in environmental samples by newly developed sorbent materials

(2016) Renata Bujak et al.   TALANTA

Preparation and application of molecularly imprinted polymer for isolation of chicoric acid from Chicorium intybus L. medicinal plant

(2015) Engy M. Saad et al.   ANALYTICA CHIMICA ACTA

A novel molecularly imprinted method with computational simulation for the affinity isolation and knockout of baicalein fromScutellaria baicalensis

(2015) Hong Li et al.   BIOMEDICAL CHROMATOGRAPHY

Nicotine molecularly imprinted polymer: Synergy of coordination and hydrogen bonding

(2015) Tan-Phat Huynh et al.   BIOSENSORS & BIOELECTRONICS

Molecular dynamics simulations of molecularly imprinted polymer approaches to the preparation of selective materials to remove norfloxacin

(2015) Yu Kong et al.   JOURNAL OF APPLIED POLYMER SCIENCE

Molecularly imprinted polymer prepared by Pickering emulsion polymerization for removal of acephate residues from contaminated waters

(2015) Xiaoping Luo et al.   JOURNAL OF APPLIED POLYMER SCIENCE

Optimization of enrofloxacin-imprinted polymers by computer-aided design

(2015) Zhengqiang Dai et al.   JOURNAL OF MOLECULAR MODELING

Theoretical and experimental research on the self-assembled system of molecularly imprinted polymers formed by salbutamol and methacrylic acid

(2015) Liu Jun-Bo et al.   JOURNAL OF SEPARATION SCIENCE

Binding characteristics of molecularly imprinted polymers based on fungicides in hydroalcoholic media

(2015) Manal Bitar et al.   JOURNAL OF SEPARATION SCIENCE

Surface imprinted polymers for oil denitrification with the combination of computational simulation and multi-template molecular imprinting

(2015) Pengfei Ma et al.   POLYMERS FOR ADVANCED TECHNOLOGIES

Preparation and Recognition Characteristics of Thymopentin Molecularly Imprinted Polymers on SiO2

(2015) Sen Hou et al.   ADSORPTION SCIENCE & TECHNOLOGY

A computational exploration of imprinted polymer affinity based on voriconazole metabolites

(2014) M. Sobiech et al.   ANALYST

Molecularly imprinted polymers based on SBA-15 for selective solid-phase extraction of baicalein from plasma samples

(2014) Hongliang He et al.   ANALYTICAL AND BIOANALYTICAL CHEMISTRY

Molecular modelling and synthesis of a polymer for the extraction of amiloride and triamterene from human urine

(2014) Iuna Tsyrulneva et al.   Analytical Methods

Computational design of an enantioselective molecular imprinted polymer for the solid phase extraction of S-warfarin from plasma

(2014) F. Ahmadi et al.   JOURNAL OF CHROMATOGRAPHY A

Molecularly imprinted polymer cartridges coupled to high performance liquid chromatography (HPLC-UV) for simple and rapid analysis of fenthion in olive oil

(2014) Idriss Bakas et al.   TALANTA

A separation of tyramine on a 2-(4-methoxyphenyl)ethylamine imprinted polymer: An answer from theoretical and experimental studies

(2014) Piotr Luliński et al.   TALANTA

Recent advances in solid-phase sorbents for sample preparation prior to chromatographic analysis

(2014) Yingying Wen et al.   TRAC-TRENDS IN ANALYTICAL CHEMISTRY

Rational synthesis of pindolol imprinted polymer by non-covalent protocol based on computational approach

(2013) Kiran Kumar Tadi et al.   JOURNAL OF MOLECULAR MODELING

Performance of M06, M06-2X, and M06-HF Density Functionals for Conformationally Flexible Anionic Clusters: M06 Functionals Perform Better than B3LYP for a Model System with Dispersion and Ionic Hydrogen-Bonding Interactions

(2013) Martin Walker et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Excited state proton-coupled electron transfer in 8-oxoG–C and 8-oxoG–A base pairs: a time dependent density functional theory (TD-DFT) study

(2013) Anil Kumar et al.   PHOTOCHEMICAL & PHOTOBIOLOGICAL SCIENCES

Study of the Molecularly Imprinted Polymers for Selective Binding of the Mono-Substituted Sulfonylurea Herbicides

(2012) S. Wang et al.   JOURNAL OF CHROMATOGRAPHIC SCIENCE

Validation of computational approach to study monomer selectivity toward the template Gallic acid for rational molecularly imprinted polymer design

(2012) Sushma Pardeshi et al.   JOURNAL OF MOLECULAR MODELING

Preparation of molecular imprinted polymers using bi-functional monomer and bi-crosslinker for solid-phase extraction of rutin

(2012) Huan Zeng et al.   TALANTA

Synthesis of Molecularly Imprinted Polymers for Amino Acid Derivates by Using Different Functional Monomers

(2011) Sonia Scorrano et al.   INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES

Density Functional Theory for Reaction Energies: Test of Meta and Hybrid Meta Functionals, Range-Separated Functionals, and Other High-Performance Functionals

(2011) Yan Zhao et al.   Journal of Chemical Theory and Computation

Rationally designed molecularly imprinted polymers for selective extraction of methocarbamol from human plasma

(2011) Mohammad Bagher Gholivand et al.   TALANTA

Synthesis and characterization of molecularly imprinted polymers for selective solid-phase extraction of pseudoephedrine

(2010) Naghmeh Arabzadeh et al.   COLLOID JOURNAL

Development of a model for the rational design of molecular imprinted polymer: Computational approach for combined molecular dynamics/quantum mechanics calculations

(2009) Cunku Dong et al.   ANALYTICA CHIMICA ACTA

Melamine Acoustic Chemosensor Based on Molecularly Imprinted Polymer Film

(2009) Agnieszka Pietrzyk et al.   ANALYTICAL CHEMISTRY

Dispersion interactions in density-functional theory

(2009) Erin R. Johnson et al.   JOURNAL OF PHYSICAL ORGANIC CHEMISTRY