Development of Measurement Tools for High-Throughput Experiments of Synchrotron Radiation XRD and XAFS on Powder Libraries.

Abstract:

:We propose to minimize the sampling time for high-throughput measurements of powder X-ray diffraction (XRD) and X-ray absorption fine structure (XAFS) in synchrotron radiation. The conventional synchrotron radiation powder X-ray diffraction method requires filling of a capillary tube, but a structure-refining diffraction pattern could be obtained by transferring the crushed powder to a tape and rotating the cassette-tape tool by ±5° around the sample position. XAFS spectra could also be measured with the sample attached to the tape. The time required for sample preparation was greatly reduced, which made high-throughput experiments with powders in synchrotron radiation experiments more accessible.

journal_name

ACS Comb Sci

authors

Fujimoto K,Aimi A,Maruyama S

doi

10.1021/acscombsci.0c00174

subject

Has Abstract

pub_date

2020-12-14 00:00:00

pages

734-737

issue

12

eissn

2156-8952

issn

2156-8944

journal_volume

22

pub_type

杂志文章
  • Efficient domino strategy for the synthesis of polyfunctionalized benzofuran-4(5H)-ones and cinnoline-4-carboxamides.

    abstract::An efficient, three-component strategy for the improved synthesis of multifunctionalized 6,7-dihydrobenzofuran-4(5H)-ones under microwave irradiation in ethyl alcohol within short periods has been established. The synthesized benzofuran-4(5H)-ones have been readily converted into polyfunctionalized cinnoline-4-carboxa...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/co5000097

    authors: Ma GH,Tu XJ,Ning Y,Jiang B,Tu SJ

    更新日期:2014-06-09 00:00:00

  • Metal-free, ionic liquid-mediated synthesis of functionalized quinolines.

    abstract::An expedient and metal-free synthetic protocol for construction of substituted quinolines has been developed from anilines and phenylacetaldehydes using imidazolium cation-based ionic liquids as the reaction medium. Mechanistic analysis indicated that the reaction occurs through C-C and C-N bond formation to produce i...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/co500047w

    authors: Bharate JB,Bharate SB,Vishwakarma RA

    更新日期:2014-11-10 00:00:00

  • Combinatorial high-throughput screening for highly active Pd-Ir-Ce based ternary catalysts in electrochemical oxygen reduction reaction.

    abstract::A combinatorial library having 66 different ternary compositions of Pd-Ir-Ce was prepared via the impregnation method to find the optimum ternary composition with the highest performance toward oxygen reduction reaction (ORR) in acid media. Its performance in ORR activity of the combinatorial array was evaluated throu...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/co400008v

    authors: Park SH,Choi CH,Koh JK,Pak C,Jin SA,Woo SI

    更新日期:2013-11-11 00:00:00

  • Application of High-Throughput Seebeck Microprobe Measurements on Thermoelectric Half-Heusler Thin Film Combinatorial Material Libraries.

    abstract::In view of the variety and complexity of thermoelectric (TE) material systems, combinatorial approaches to materials development come to the fore for identifying new promising compounds. The success of this approach is related to the availability and reliability of high-throughput characterization methods for identify...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/acscombsci.7b00019

    authors: Ziolkowski P,Wambach M,Ludwig A,Mueller E

    更新日期:2018-01-08 00:00:00

  • Combinatorial screening of potentiometric Pb(II) sensors from polysulfoaminoanthraquinone solid ionophore.

    abstract::A potentiometric Pb(II)-selective sensor was fabricated by a combinatorial screening of electrically conducting polysulfoaminoanthraquinone (PSA) nanoparticles as a solid ionophore, ion exchangers (oleic acid (OA) and NaTPB), plasticizers in a polyvinyl chloride (PVC) matrix, membrane thickness, inner filling ion spec...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/co400140g

    authors: Huang MR,Ding YB,Li XG

    更新日期:2014-03-10 00:00:00

  • In Vitro Identification of the Hamiltonian Cycle Using a Circular Structure Assisted DNA Computer.

    abstract::Adleman's illustration of molecular computing using DNA paved the way toward an entirely new direction of computing (Adleman, L. M. Science 1994, 266, 1021). The exponential time complex combinatorial problem on a traditional computer turns out to be a separation problem involving a polynomial number of steps in DNA c...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/acscombsci.9b00150

    authors: Sharma D,Ramteke M

    更新日期:2020-05-11 00:00:00

  • Incorporation of Fluorine into an OBOC Peptide Library by Copper-Free Click Chemistry toward the Discovery of PET Imaging Agents.

    abstract::A one-bead one-compound (OBOC) library of peptide-based imaging agents was developed where a 19F-containing moiety was added onto the N-terminus of octamer peptides through copper-free click chemistry prior to screening of the library. This created a library of complete imaging agents that was screened against CXCR4, ...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/acscombsci.9b00146

    authors: Murrell E,Luyt LG

    更新日期:2020-03-09 00:00:00

  • Combinatorial Investigations of High Temperature CuNb Oxide Phases for Photoelectrochemical Water Splitting.

    abstract::High-throughput combinatorial methods have been useful in identifying new oxide semiconductors with the potential to be applied to solar water splitting. Most of these techniques have been limited to producing and screening oxide phases formed at temperatures below approximately 550 °C. We report the development of a ...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/acscombsci.5b00142

    authors: Skorupska K,Maggard PA,Eichberger R,Schwarzburg K,Shahbazi P,Zoellner B,Parkinson BA

    更新日期:2015-12-14 00:00:00

  • Polymer-supported stereoselective synthesis of tetrahydro-2H-oxazolo[3,2-a]pyrazin-5(3H)-ones from N-(2-oxo-ethyl)-derivatized dipeptides via eastbound iminiums.

    abstract::Polymer-supported N-(2-oxo-ethyl)-derivatized Ser/Thr/Cys-containing dipeptides were synthesized and subjected to acid-mediated tandem N-acylium ion cyclization-nucleophilic addition to yield tetrahydro-2H-oxazolo[3,2-a]pyrazin-5(3H)-ones. The reaction conditions and building-block combinations for stereoselective syn...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/co3001567

    authors: La Venia A,Dolenský B,Krchňák V

    更新日期:2013-03-11 00:00:00

  • High-Throughput Screening and Hit Validation of Extracellular-Related Kinase 5 (ERK5) Inhibitors.

    abstract::The extracellular-related kinase 5 (ERK5) is a promising target for cancer therapy. A high-throughput screen was developed for ERK5, based on the IMAP FP progressive binding system, and used to identify hits from a library of 57 617 compounds. Four distinct chemical series were evident within the screening hits. Resyn...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/acscombsci.5b00155

    authors: Myers SM,Bawn RH,Bisset LC,Blackburn TJ,Cottyn B,Molyneux L,Wong AC,Cano C,Clegg W,Harrington RW,Leung H,Rigoreau L,Vidot S,Golding BT,Griffin RJ,Hammonds T,Newell DR,Hardcastle IR

    更新日期:2016-08-08 00:00:00

  • Synthesis of a drug-like focused library of trisubstituted pyrrolidines using integrated flow chemistry and batch methods.

    abstract::A combination of flow and batch chemistries has been successfully applied to the assembly of a series of trisubstituted drug-like pyrrolidines. This study demonstrates the efficient preparation of a focused library of these pharmaceutically important structures using microreactor technologies, as well as classical par...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/co2000357

    authors: Baumann M,Baxendale IR,Kuratli C,Ley SV,Martin RE,Schneider J

    更新日期:2011-07-11 00:00:00

  • Parallel Synthesis of 1H-Pyrazolo[3,4-d]pyrimidines via Condensation of N-Pyrazolylamides and Nitriles.

    abstract::A novel parallel medicinal chemistry (PMC)-enabled synthesis of 1H-pyrazolo[3,4-d]pyrimidines employing condensation of easily accessible N-pyrazolylamides and nitriles has been developed. The presented studies describe singleton and library enablements that allowed rapid generation of molecular diversity to examine C...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/acscombsci.7b00116

    authors: Shah AA,Chenard LK,Tucker JW,Helal CJ

    更新日期:2017-11-13 00:00:00

  • One-Pot Synthesis of Unsymmetrical Bis-Heterocycles: Benzimidazole-, Benzoxazole-, and Benzothiazole-Linked Thiazolidines.

    abstract::A one-pot, three-component synthesis of benzimidazole-linked thiazolidines from 2-cyanomethyl benzimidazole, iso-, isothio-, or isoselenocyanates and 1,2-dichloroethane is reported. Isolation of the key intermediate formed during the course of the reaction validates its mechanistic pathway. Under the same reaction con...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/acscombsci.9b00161

    authors: Lu HY,Barve IJ,Selvaraju M,Sun CM

    更新日期:2020-01-13 00:00:00

  • Combinatorial synthesis of functionalized spirooxindole-pyrrolidine/pyrrolizidine/pyrrolothiazole derivatives via three-component 1,3-dipolar cycloaddition reactions.

    abstract::A series of diverse polycyclic heterocycles containing spirooxindole, pyridine/thiophene, and pyrrolidine/pyrrolizidine/pyrrolothiazole rings have been synthesized through the 1,3-dipolar cycloaddition of azomethine ylides generated in situ by the condensation of dicarbonyl compounds (isatin or acenaphthenequinone) an...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/co500085t

    authors: Li J,Wang J,Xu Z,Zhu S

    更新日期:2014-09-08 00:00:00

  • Synthesis of Aminofuran-Linked Benzimidazoles and Cyanopyrrole-Fused Benzimidazoles by Condition-Based Skeletal Divergence.

    abstract::A condition-based skeletal divergent synthesis was explored to achieve skeletal diversity in two component condensation reaction. Cyanomethyl benzimidazole was reacted with α-bromoketone under thermal conditions to furnish 2-aminofuranyl-benzimidazoles, while the same reaction afforded 3-cyano-benzopyrrolo-imidazoles ...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/acscombsci.7b00052

    authors: Hsu WS,Tsai MH,Barve IJ,Yellol GS,Sun CM

    更新日期:2017-07-10 00:00:00

  • A Novel pseudo-Four-Component Domino Reaction for the Synthesis of Naphtho[2,1-b]furan-2(1H)-ones Using a Nanocatalyst.

    abstract::In this article, an original one-pot method is utilized to synthesize a variety of derivatives of naphtho[2,1-b]furan-2(1H)-one via a pseudo-four-component domino reaction of aryl aldehydes, acetic anhydride, hippuric acids, and 2-naphthols catalyzed by HSW@SPIONs. This reaction illustrates an array of attractive feat...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/acscombsci.5b00018

    authors: Salami-Ranjbaran E,Khosropour AR,Mohammadpoor-Baltork I,Moghadam M,Tangestaninejad S,Mirkhani V

    更新日期:2015-08-10 00:00:00

  • An Engineered Sso7d Variant Enables Efficient Magnetization of Yeast Cells.

    abstract::Magnetization using cheap and minimally toxic materials, such as iron oxide nanoparticles can enable easy separation of cells from culture medium and is relevant to several industrial applications. Here, we show that cell surface expression of a mutant protein that binds iron oxide can enable efficient magnetization o...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/acscombsci.8b00084

    authors: Cruz-Teran CA,Bacon K,McArthur N,Rao BM

    更新日期:2018-10-08 00:00:00

  • Geometrical Properties Can Predict CO2 and N2 Adsorption Performance of Metal-Organic Frameworks (MOFs) at Low Pressure.

    abstract::Metal-organic frameworks (MOFs) are nanoporous materials with exceptional host-guest properties poised for groundbreaking innovations in gas separation applications according to high-throughput (HT) screening data. However, MOF structural libraries are nearly infinite in practice and so statistical and information tec...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/acscombsci.5b00188

    authors: Fernandez M,Barnard AS

    更新日期:2016-05-09 00:00:00

  • Facile diversity-oriented synthesis and antitubercular evaluation of novel aryl and heteroaryl tethered pyridines and dihydro-6H-quinolin-5-ones derived via variants of the Bohlmann-Rahtz Reaction.

    abstract::The diversity oriented synthesis of substituted pyridines and dihydro-6H-quinolin-5-ones tethered with aryls and heteroaryls was achieved in very good yields through CeCl(3)·7H(2)O-NaI catalyst via variants of the Bohlmann-Rahtz reaction. β-Enaminones derived from various aryl and heteroaryl methyl ketones were regios...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/co2000604

    authors: Kantevari S,Patpi SR,Addla D,Putapatri SR,Sridhar B,Yogeeswari P,Sriram D

    更新日期:2011-07-11 00:00:00

  • One-pot multicomponent synthesis of highly functionalized piperidines from substituted β-nitrostyrenes, Meldrum's acid, aromatic aldehydes, and ammonium acetate.

    abstract::An efficient and straightforward synthetic protocol has been developed for the diversity-oriented synthesis of highly functionalized piperidines containing a Meldrum's acid moiety via pseudo five-component reaction between aromatic aldehydes, ammonium acetate, substituted β-nitrostyrenes and Meldrum's acid for the gen...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/co4001502

    authors: Li Y,Xue Z,Ye W,Liu J,Yao J,Wang C

    更新日期:2014-03-10 00:00:00

  • Machine Learning Prediction of the Energy Gap of Graphene Nanoflakes Using Topological Autocorrelation Vectors.

    abstract::The possibility of band gap engineering in graphene opens countless new opportunities for application in nanoelectronics. In this work, the energy gaps of 622 computationally optimized graphene nanoflakes were mapped to topological autocorrelation vectors using machine learning techniques. Machine learning modeling re...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/acscombsci.6b00094

    authors: Fernandez M,Abreu JI,Shi H,Barnard AS

    更新日期:2016-11-14 00:00:00

  • Discovery of Novel Tricyclic Thiazepine Derivatives as Anti-Drug-Resistant Cancer Agents by Combining Diversity-Oriented Synthesis and Converging Screening Approach.

    abstract::An efficient discovery strategy by combining diversity-oriented synthesis and converging cellular screening is described. By a three-round screening process, we identified novel tricyclic pyrido[2,3-b][1,4]benzothiazepines showing potent inhibitory activity against paclitaxel-resistant cell line H460TaxR (EC50 < 1.0 μ...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/acscombsci.6b00010

    authors: Xiang J,Zhang Z,Mu Y,Xu X,Guo S,Liu Y,Russo DP,Zhu H,Yan B,Bai X

    更新日期:2016-05-09 00:00:00

  • Exploring the First High-Entropy Thin Film Libraries: Composition Spread-Controlled Crystalline Structure.

    abstract::Thin films of two types of high-entropy oxides (HEOs) have been deposited on 76.2 mm Si wafers using combinatorial sputter deposition. In one type of the oxides, (MgZnMnCoNi)O x , all the metals have a stable divalent oxidation state and similar cationic radii. In the second...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/acscombsci.0c00159

    authors: Nguyen TX,Su YH,Hattrick-Simpers J,Joress H,Nagata T,Chang KS,Sarker S,Mehta A,Ting JM

    更新日期:2020-12-14 00:00:00

  • A Novel Mechanistic Study on Ultrasound-Assisted, One-Pot Synthesis of Functionalized Benzimidazo[2,1-b]quinazolin-1(1H)-ones.

    abstract::Ultrasound-assisted synthesis of benzimidazo[2,1-b]quinazolin-1(1H)-ones was achieved via piperidine-catalyzed three-component reaction of 2-aminobenzimidazoles, an aromatic aldehyde, and 1,3-dione in aqueous isopropanol. This mechanism was first suspected following our identification of unusual reaction intermediates...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/acscombsci.5b00186

    authors: Chen LH,Chung TW,Narhe BD,Sun CM

    更新日期:2016-03-14 00:00:00

  • Optimization of Criteria for an Efficient Screening of New Thermoelectric Compounds: The TiNiSi Structure-Type as a Case-Study.

    abstract::High-throughput calculations can be applied to a large number of compounds, in order to discover new useful materials. In the present work, ternary intermetallic compounds are investigated, to find new potentially interesting materials for thermoelectric applications. The screening of stable nonmetallic compounds requ...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/acscombsci.0c00133

    authors: Barreteau C,Crivello JC,Joubert JM,Alleno E

    更新日期:2020-12-14 00:00:00

  • Immobilized N-chlorosuccinimide as a friendly peptide disulfide-forming reagent.

    abstract::A novel immobilized N-chlorosuccinimide resin was developed for peptide disulfide bond formation in combinatorial libraries. The resin is prepared in a simple two-step process from commercial starting materials. Disulfide formation is initiated by adding a peptide solution to the resin, and excess reagent is removed b...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/co500003p

    authors: Postma TM,Albericio F

    更新日期:2014-04-14 00:00:00

  • Venting-while-heating microwave-assisted synthesis of 3-arylthioindoles.

    abstract::We report the first example of venting-while-heating microwave-assisted synthesis of a small library of 3-arylthioindoles. Compounds were prepared in excellent isolated yields (90-98%) within 4 min in a closed vessel by treating indoles with disulfides in the presence of sodium hydride in anhydrous N,N-dimethylformami...

    journal_title:ACS combinatorial science

    pub_type: 信件

    doi:10.1021/co200165j

    authors: La Regina G,Gatti V,Famiglini V,Piscitelli F,Silvestri R

    更新日期:2012-04-09 00:00:00

  • Competition-Enhanced Ligand Selection to Identify DNA Aptamers.

    abstract::Competition-enhanced ligand screening (CompELS) was employed to rapidly screen through large DNA libraries to identify single-stranded, oligonucleotide-based ligands called aptamers that bind to a nonbiological target. This previously unreported aptamer screening approach involves the repeated introduction of unenrich...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/acscombsci.8b00048

    authors: Tapp MJN,Slocik JM,Dennis PB,Naik RR,Milam VT

    更新日期:2018-10-08 00:00:00

  • Microgradient-heaters as tools for high-throughput experimentation.

    abstract::A microgradient-heater (MGH) was developed, and its feasibility as a tool for high-throughput materials science experimentation was tested. The MGH is derived from microhot plate (MHP) systems and allows combinatorial thermal processing on the micronano scale. The temperature gradient is adjustable by the substrate ma...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/co3000488

    authors: Meyer R,Hamann S,Ehmann M,Thienhaus S,Jaeger S,Thiede T,Devi A,Fischer RA,Ludwig A

    更新日期:2012-10-08 00:00:00

  • Facile (triazolyl)methylation of MACOS-derived benzofused sultams utilizing ROMP-derived OTP reagents.

    abstract::A combination of MACOS scale-out and ROMP-derived oligomeric triazole phosphates (OTP(n)) have been successfully utilized for the preparation of a 106-member library of triazole containing benzothiaoxazepine-1,1-dioxides. This report demonstrates the utilization of a suite of soluble OTP(n) reagents for facile (triazo...

    journal_title:ACS combinatorial science

    pub_type: 杂志文章

    doi:10.1021/co2001839

    authors: Faisal S,Ullah F,Maity PK,Rolfe A,Samarakoon TB,Porubsky P,Neuenswander B,Lushington GH,Basha FZ,Organ MG,Hanson PR

    更新日期:2012-04-09 00:00:00