Works matching DE "CONFORMATIONAL analysis"

Results: 3124

Ab initio and DFT computational studies on molecular conformations and intramolecular hydrogen bonding in 3-mercapto-but-2-enethial.

Published in:

Journal of Sulfur Chemistry, 2010, v. 31, n. 4, p. 275, doi. 10.1080/17415993.2010.492871

By:

Nadim, EmadSaleh;
Raissi, Heidar;
Yoosefian, Mehdi;
Farzad, Farzaneh;
Nowroozi, AliReza

Publication type:

Article

Tandem Domains with Tuned Interactions Are a Powerful Biological Design Principle.

Published in:

PLoS Biology, 2015, v. 13, n. 12, p. 1, doi. 10.1371/journal.pbio.1002306

By:

Nussinov, Ruth;
Tsai, Chung-Jung

Publication type:

Article

Conformational Changes during Pore Formation by the Perforin-Related Protein Pleurotolysin.

Published in:

PLoS Biology, 2015, v. 13, n. 2, p. 1, doi. 10.1371/journal.pbio.1002049

By:

Lukoyanova, Natalya;
Kondos, Stephanie C.;
Farabella, Irene;
Law, Ruby H. P.;
Reboul, Cyril F.;
Caradoc-Davies, Tom T.;
Spicer, Bradley A.;
Kleifeld, Oded;
Traore, Daouda A. K.;
Ekkel, Susan M.;
Voskoboinik, Ilia;
Trapani, Joseph A.;
Hatfaludi, Tamas;
Oliver, Katherine;
Hotze, Eileen M.;
Tweten, Rodney K.;
Whisstock, James C.;
Topf, Maya;
Saibil, Helen R.;
Dunstone, Michelle A.

Publication type:

Article

Pre-B Cell Receptor Signaling Induces Immunoglobulin κ Locus Accessibility by Functional Redistribution of Enhancer-Mediated Chromatin Interactions.

Published in:

PLoS Biology, 2014, v. 12, n. 2, p. 1, doi. 10.1371/journal.pbio.1001791

By:

Stadhouders, Ralph;
de Bruijn, Marjolein J. W.;
Rother, Magdalena B.;
Yuvaraj, Saravanan;
de Almeida, Claudia Ribeiro;
Kolovos, Petros;
Van Zelm, Menno C.;
van Ijcken, Wilfred;
Grosveld, Frank;
Soler, Eric;
Hendriks, Rudi W.

Publication type:

Article

A Little Switch: Alternative Domain Conformations Control Bacterial Flagella Rotation Direction.

Published in:

PLoS Biology, 2013, v. 11, n. 2, p. 1, doi. 10.1371/journal.pbio.1001480

By:

Robinson, Richard

Publication type:

Article

Integrated in silico–in vitro rational design of oncogenic EGFR-derived specific monoclonal antibody-binding peptide mimotopes.

Published in:

Journal of Bioinformatics & Computational Biology, 2023, v. 21, n. 2, p. 1, doi. 10.1142/S0219720023500075

By:

Chen, Ke;
Ge, Lili;
Liu, Guorui

Publication type:

Article

NEAT-FLEX: Predicting the conformational flexibility of amino acids using neuroevolution of augmenting topologies.

Published in:

Journal of Bioinformatics & Computational Biology, 2017, v. 15, n. 3, p. -1, doi. 10.1142/S0219720017500093

By:

Grisci, Bruno;
Dorn, Márcio

Publication type:

Article

Supervised learning method for predicting chromatin boundary associated insulator elements.

Published in:

Journal of Bioinformatics & Computational Biology, 2014, v. 12, n. 6, p. -1, doi. 10.1142/S0219720014420062

By:

Bednarz, Paweł;
Wilczyński, Bartek

Publication type:

Article

Role of arginine 209 in the conformational transition of the protein kinase A regulatory subunit RIα A-domain.

Published in:

Journal of Bioinformatics & Computational Biology, 2014, v. 12, n. 2, p. -1, doi. 10.1142/S0219720014410054

By:

Rogacheva, Olga N.;
Stefanov, Vasiliy E.;
Shchegolev, Boris F.;
Vershinina, Elena A.;
Savvateeva-Popova, Elena V.

Publication type:

Article

IN SEARCH OF THE PROTEIN NATIVE STATE WITH A PROBABILISTIC SAMPLING APPROACH.

Published in:

Journal of Bioinformatics & Computational Biology, 2011, v. 9, n. 3, p. 383, doi. 10.1142/S0219720011005574

By:

OLSON, BRIAN;
MOLLOY, KEVIN;
SHEHU, AMARDA

Publication type:

Article

CLePAPS:: FAST PAIR ALIGNMENT OF PROTEIN STRUCTURES BASED ON CONFORMATIONAL LETTERS.

Published in:

Journal of Bioinformatics & Computational Biology, 2008, v. 6, n. 2, p. 347, doi. 10.1142/S0219720008003461

By:

WANG, SHENG;
ZHENG, WEI-MOU

Publication type:

Article

PROTEIN SIDE-CHAIN PACKING PROBLEM:: A MAXIMUM EDGE-WEIGHT CLIQUE ALGORITHMIC APPROACH.

Published in:

Journal of Bioinformatics & Computational Biology, 2005, v. 3, n. 1, p. 103, doi. 10.1142/S0219720005000904

By:

Bahadur K. C., Dukka;
Tomita, Etsuji;
Suzuki, Jun'ichi;
Akutsu, Tatsuya

Publication type:

Article

Cross-polarization dynamics and conformational study of variously sized cellulose crystallites using solid-state 13C NMR.

Published in:

Journal of Wood Science, 2020, v. 66, n. 1, p. N.PAG, doi. 10.1186/s10086-020-01909-9

By:

Daicho, Kazuho;
Fujisawa, Shuji;
Kobayashi, Kayoko;
Saito, Tsuguyuki;
Ashida, Jun

Publication type:

Article

Collapse Transition of Branched Polymers in Dilute Solutions: Telechelic Star vs. H-Polymer.

Published in:

Macromolecular Symposia, 2015, v. 354, n. 1, p. 207, doi. 10.1002/masy.201400072

By:

Dasmahapatra, Ashok Kumar;
Reddy, G. Diwakar;
Sanka, Venkata Mahanth

Publication type:

Article

Crystallization of Double Crystalline Diblock Copolymer by Dynamic Monte Carlo Simulation.

Published in:

Macromolecular Symposia, 2015, v. 354, n. 1, p. 314, doi. 10.1002/masy.201400073

By:

Kundu, Chitrita;
Dasmahapatra, Ashok Kumar

Publication type:

Article

Manifestations of Conformational Defects in Electronic Spectra of Polysilanes - a Theoretical Study.

Published in:

Macromolecular Symposia, 2014, v. 339, n. 1, p. 100, doi. 10.1002/masy.201300143

By:

Hanulikova, Barbora;
Kuritka, Ivo

Publication type:

Article

Potential of Small‐Angle Neutron Scattering for Evaluating Protein Locus within a Polymersome.

Published in:

Macromolecular Chemistry & Physics, 2023, v. 224, n. 1, p. 1, doi. 10.1002/macp.202200300

By:

Palinske, Max;
Muza, Upenyu L.;
Moreno, Silvia;
Appelhans, Dietmar;
Boye, Susanne;
Schweins, Ralf;
Lederer, Albena

Publication type:

Article

Multidetector-ThF3 as a Novel Tool for the Investigation of Solution Properties of Amphiphilic Block Copolymers.

Published in:

Macromolecular Chemistry & Physics, 2015, v. 216, n. 12, p. 1355, doi. 10.1002/macp.201500070

By:

Ngaza, Nyashadzashe;
Brand, Margaretha;
Pasch, Harald

Publication type:

Article

N‐Heterocycle‐Substituted Hexa‐peri‐Hexabenzocoronenes with Windmill Architectures.

Published in:

Chemistry - A European Journal, 2025, v. 31, n. 2, p. 1, doi. 10.1002/chem.202403124

By:

Mörsel, Sven;
Ritterhoff, Christian L.;
Kellner, René;
Meyer, Bernd;
Hirsch, Andreas

Publication type:

Article

An Efficient and Scalable "Second Generation" Total Synthesis of the Marine Polyketide Limaol Endowed with Antiparasitic Activity.

Published in:

Chemistry - A European Journal, 2024, v. 30, n. 40, p. 1, doi. 10.1002/chem.202401429

By:

Hess, Stephan N.;
Fürstner, Alois

Publication type:

Article

Conformational Analysis of (+)‐Germacrene D‐4‐ol Using the Crystalline Sponge Method to Elucidate the Origin of its Instability.

Published in:

Chemistry - A European Journal, 2024, v. 30, n. 39, p. 1, doi. 10.1002/chem.202400512

By:

Jung, Youngcheol;
Mitsuhashi, Takaaki;
Kageyama, Ko;
Kikuchi, Takashi;
Sato, Sota;
Fujita, Makoto

Publication type:

Article

Conformational and Electronic Variations in 1,2‐ and 1,5a‐Cyclophellitols and their Impact on Retaining α‐Glucosidase Inhibition.

Published in:

Chemistry - A European Journal, 2024, v. 30, n. 31, p. 1, doi. 10.1002/chem.202400723

By:

Ofman, Tim P.;
Heming, Jurriaan J. A.;
Nin‐Hill, Alba;
Küllmer, Florian;
Moran, Elisha;
Bennett, Megan;
Steneker, Roy;
Klein, Anne‐Mei;
Ruijgrok, Gijs;
Kok, Ken;
Armstrong, Zach W. B.;
Aerts, Johannes M. F. G.;
van der Marel, Gijsbert A.;
Rovira, Carme;
Davies, Gideon J.;
Artola, Marta;
Codée, Jeroen D. C.;
Overkleeft, Herman S.

Publication type:

Article

Bimodal Use of Chiral α‐Trifluoromethylalanine in Aib Foldamers: Study of the Position Impact Towards the Helical Screw‐Sense Preference.

Published in:

Chemistry - A European Journal, 2024, v. 30, n. 27, p. 1, doi. 10.1002/chem.202400540

By:

Picois, Nathan;
Bodero, Lizeth;
Milbeo, Pierre;
Brigaud, Thierry;
Chaume, Grégory

Publication type:

Article

Molecular Dynamics of Steroidal Rotors Probed by Theoretical, Spectroscopic and Dielectric Methods.

Published in:

Chemistry - A European Journal, 2024, v. 30, n. 20, p. 1, doi. 10.1002/chem.202303933

By:

Olszewska, Karolina;
Mizera, Adam;
Ławniczak, Paweł;
Kamińska, Anna;
Santillan, Rosa;
Morales‐Chamorro, Maricela;
Ochoa, Ma. Eugenia;
Farfán, Norberto;
Łapiński, Andrzej;
Górecki, Marcin;
Jastrzebska, Izabella;
Runka, Tomasz

Publication type:

Article

Solution and Solvent‐Free Stopper Exchange Reactions for the Preparation of Pillar[5]arene‐containing [2] and [3]Rotaxanes.

Published in:

Chemistry - A European Journal, 2024, v. 30, n. 12, p. 1, doi. 10.1002/chem.202304131

By:

Becharguia, Nihed;
Nierengarten, Iwona;
Strub, Jean‐Marc;
Cianférani, Sarah;
Rémy, Marine;
Wasielewski, Emeric;
Abidi, Rym;
Nierengarten, Jean‐François

Publication type:

Article

Conformational Studies of β‐Azapeptoid Foldamers: A New Class of Peptidomimetics with Confined Dihedrals.

Published in:

Chemistry - A European Journal, 2024, v. 30, n. 6, p. 1, doi. 10.1002/chem.202303330

By:

Anshulata;
Vishnoi, Pratap;
Kanta Sarma, Bani

Publication type:

Article

Synthesis and VCD Spectroscopic Characterization of a Series of Azacryptands from a Chiral Valine‐Based Derivative of Tris(2‐aminoethyl)amine (TREN).

Published in:

Chemistry - A European Journal, 2023, v. 29, n. 63, p. 1, doi. 10.1002/chem.202302126

By:

Müller, Clemens;
Scholten, Kevin;
Engelage, Elric;
Merten, Christian

Publication type:

Article

Cover Feature: Synthesis and Conformational Analysis of Fullerene Torsion Balances for Assessing the Contribution of Dispersion and Anionic Character in Non‐Covalent Arene–Fullerene Interactions (Chem. Eur. J. 44/2023).

Published in:

Chemistry - A European Journal, 2023, v. 29, n. 44, p. 1, doi. 10.1002/chem.202301964

By:

Yamada, Michio;
Sahara, Koki;
Koizumi, Masaaki;
Maeda, Yutaka;
Suzuki, Mitsuaki

Publication type:

Article

Synthesis and Conformational Analysis of Fullerene Torsion Balances for Assessing the Contribution of Dispersion and Anionic Character in Non‐Covalent Arene–Fullerene Interactions.

Published in:

Chemistry - A European Journal, 2023, v. 29, n. 44, p. 1, doi. 10.1002/chem.202300877

By:

Yamada, Michio;
Sahara, Koki;
Koizumi, Masaaki;
Maeda, Yutaka;
Suzuki, Mitsuaki

Publication type:

Article

A Predictive Model for the Pd‐Catalyzed Site‐Selective Oxidation of Diols.

Published in:

Chemistry - A European Journal, 2023, v. 29, n. 44, p. 1, doi. 10.1002/chem.202300318

By:

Marinus, Nittert;
Eisink, Niek N. H. M.;
Reintjens, Niels R. M.;
Dijkstra, Renger S.;
Havenith, Remco W. A.;
Minnaard, Adriaan J.;
Witte, Martin D.

Publication type:

Article

Inversion of Diaza[5]Helicenes Through an N−N Bond Breaking Pathway.

Published in:

Chemistry - A European Journal, 2023, v. 29, n. 43, p. 1, doi. 10.1002/chem.202301466

By:

Kobayashi, Toshifumi;
Ishiwari, Fumitaka;
Fukushima, Takanori;
Nojima, Yuki;
Hasegawa, Masashi;
Mazaki, Yasuhiro;
Hanaya, Kengo;
Sugai, Takeshi;
Higashibayashi, Shuhei

Publication type:

Article

Exchanged Metal‐Hydrogen Anagostic Bonds and Resonance of Dithiocarbamate and Thioureide Mesomers**.

Published in:

Chemistry - A European Journal, 2022, v. 28, n. 45, p. 1, doi. 10.1002/chem.202201235

By:

Sobczak, Szymon;
Roszak, Kinga;
Katrusiak, Andrzej

Publication type:

Article

Impact of Intermolecular Non‐Covalent Interactions in a CuI8PdII1 Discrete Assembly: Conformers' Geometries and Stimuli‐Sensitive Luminescence Properties.

Published in:

Chemistry - A European Journal, 2022, v. 28, n. 24, p. 1, doi. 10.1002/chem.202104497

By:

Moutier, Florent;
Schiller, Jana;
Lecourt, Constance;
Khalil, Ali Moustafa;
Delmas, Vincent;
Calvez, Guillaume;
Costuas, Karine;
Lescop, Christophe

Publication type:

Article

Foldamer-Mediated Remote Stereocontrol: >1,60 Asymmetric Induction.

Published in:

Angewandte Chemie, 2014, v. 126, n. 1, p. 155, doi. 10.1002/ange.201308264

By:

Byrne, Liam;
Solà, Jordi;
Boddaert, Thomas;
Marcelli, Tommaso;
Adams, Ralph W.;
Morris, Gareth A.;
Clayden, Jonathan

Publication type:

Article

Controlling the Molecular Topology of Vinylogous Iminium Ions by Logical Substrate Design: Highly Regio- and Stereoselective Aminocatalytic 1,6-Addition to Linear 2,4-Dienals.

Published in:

Angewandte Chemie, 2013, v. 125, n. 41, p. 10980, doi. 10.1002/ange.201305870

By:

Silvi, Mattia;
Chatterjee, Indranil;
Liu, Yiankai;
Melchiorre, Paolo

Publication type:

Article

Rigid DNA Beams for High-Resolution Single-Molecule Mechanics.

Published in:

Angewandte Chemie, 2013, v. 125, n. 30, p. 7920, doi. 10.1002/ange.201302727

By:

Pfitzner, Emanuel;
Wachauf, Christian;
Kilchherr, Fabian;
Pelz, Benjamin;
Shih, William M.;
Rief, Matthias;
Dietz, Hendrik

Publication type:

Article

Optimizing P,N-Bidentate Ligands for Oxidative Gold Catalysis: Efficient Intermolecular Trapping of α-Oxo Gold Carbenes by Carboxylic Acids.

Published in:

Angewandte Chemie, 2013, v. 125, n. 25, p. 6636, doi. 10.1002/ange.201301601

By:

Ji, Kegong;
Zhao, Yulong;
Zhang, Liming

Publication type:

Article

Sulfur-Enriched Conjugated Polymer Nanosheet Derived Sulfur and Nitrogen co-Doped Porous Carbon Nanosheets as Electrocatalysts for Oxygen Reduction Reaction and Zinc-Air Battery.

Published in:

Advanced Functional Materials, 2016, v. 26, n. 32, p. 5893, doi. 10.1002/adfm.201602158

By:

Su, Yuezeng;
Yao, Zhaoquan;
Zhang, Fan;
Wang, Hai;
Mics, Zoltan;
Cánovas, Enrique;
Bonn, Mischa;
Zhuang, Xiaodong;
Feng, Xinliang

Publication type:

Article

Conjugated Polyelectrolyte and Aptamer Based Potassium Assay via Single- and Two-Step Fluorescence Energy Transfer with a Tunable Dynamic Detection Range.

Published in:

Advanced Functional Materials, 2014, v. 24, n. 12, p. 1748, doi. 10.1002/adfm.201301515

By:

Nguyen, Bao Lam;
Jeong, Ji‐Eun;
Jung, In Hwan;
Kim, Boram;
Le, Van Sang;
Kim, Inhong;
Kyhm, Kwangseuk;
Woo, Han Young

Publication type:

Article

In vivo NMR as a tool for probing molecular structure and dynamics in intact Chlamydomonas reinhardtii cells.

Published in:

Photosynthesis Research, 2018, v. 135, n. 1-3, p. 227, doi. 10.1007/s11120-017-0412-9

By:

Azadi-Chegeni, Fatemeh;
Schiphorst, Christo;
Pandit, Anjali

Publication type:

Article

Rethinking the existence of a steady-state Δ ψ component of the proton motive force across plant thylakoid membranes.

Published in:

Photosynthesis Research, 2014, v. 119, n. 1/2, p. 233, doi. 10.1007/s11120-013-9817-2

By:

Johnson, Matthew;
Ruban, Alexander

Publication type:

Article

Accuracy of Optimized Chemical-exchange Parameters Derived by Fitting CPMG R 2 Dispersion Profiles when R ≠ R.

Published in:

Journal of Biomolecular NMR, 2006, v. 34, n. 4, p. 209, doi. 10.1007/s10858-005-6226-7

By:

Ishima, Rieko;
Torchia, Dennis

Publication type:

Article

A New Amide Proton R1ρ Experiment Permits Accurate Characterization of Microsecond Time-scale Conformational Exchange.

Published in:

Journal of Biomolecular NMR, 2005, v. 32, n. 4, p. 281, doi. 10.1007/s10858-005-0658-y

By:

Eichmüller, Christian;
Skrynnikov, Nikolai R.

Publication type:

Article

Protein energetic conformational analysis from NMR chemical shifts (PECAN) and its use in determining secondary structural elements.

Published in:

Journal of Biomolecular NMR, 2005, v. 32, n. 1, p. 71, doi. 10.1007/s10858-005-5705-1

By:

Eghbalnia, Hamid R.;
Wang, Liya;
Bahrami, Arash;
Assadi, Amir;
Markley, John L.

Publication type:

Article

Analysis of local conformation of membrane-bound and polycrystalline peptides by two-dimensional slow-spinning rotor-synchronized MAS exchange spectroscopy.

Published in:

Journal of Biomolecular NMR, 2003, v. 26, n. 1, p. 49, doi. 10.1023/A:1023060102409

By:

Gabrys, Charles M.;
Jun Yang;
Weliky, David P.

Publication type:

Article

Improved TROSY-HNCA experiment with suppression of conformational exchange induced relaxation.

Published in:

Journal of Biomolecular NMR, 2001, v. 21, n. 2, p. 161, doi. 10.1023/A:1012484027195

By:

Pervushin, Konstantin;
Gallius, Veniamin;
Ritter, Christiane

Publication type:

Article

Chain conformation and dynamics in ultrahigh molecular weight polyethylene melts undergoing extensional–shear coupled flow: insight from dissipative particle dynamics simulation.

Published in:

Polymer International, 2020, v. 69, n. 12, p. 1213, doi. 10.1002/pi.6064

By:

Wang, Junxia;
Chen, Xiaochuan;
Cao, Changlin;
Yu, Dingshan

Publication type:

Article

Direct rRNA Fingerprinting, a Novel Method to Profile Low Diversity Microbial Communities.

Published in:

Microbial Ecology, 2011, v. 62, n. 1, p. 177, doi. 10.1007/s00248-011-9877-9

By:

Gutierrez-Zamora, Maria-Luisa;
Zemb, Olivier;
Manefield, Mike

Publication type:

Article

Convergence in peptide folding simulation: Multiple trajectories of a potential AIDS pharmacophore.

Published in:

Biopolymers, 2003, v. 70, n. 2, p. 121, doi. 10.1002/bip.10401

By:

Dan Mihailescu;
Jennifer Reed;
Jeremy C. Smith

Publication type:

Article

Conformational analysis of the exopolysaccharide from Burkholderia caribensis strain MWAP71: Impact on the interaction with soils.

Published in:

Biopolymers, 2003, v. 69, n. 4, p. 480, doi. 10.1002/bip.10432

By:

Cécile Vanhaverbeke;
Alain Heyraud;
Karim Mazeau

Publication type:

Article