Induced Dipoles Incorporated into All-Atom Zn Protein Simulations with Multiscale Modeling (English)
- New search for: Huang, Y.-D.
- New search for: Shuai, J.-W.
- New search for: Huang, Y.-D.
- New search for: Shuai, J.-W.
In:
JOURNAL OF PHYSICAL CHEMISTRY B
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117
, 20
;
6138-6148
;
2013
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ISSN:
- Article (Journal) / Print
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Title:Induced Dipoles Incorporated into All-Atom Zn Protein Simulations with Multiscale Modeling
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Contributors:Huang, Y.-D. ( author ) / Shuai, J.-W. ( author )
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Published in:JOURNAL OF PHYSICAL CHEMISTRY B ; 117, 20 ; 6138-6148
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Publisher:
- New search for: AMERICAN CHEMICAL SOCIETY
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Publication date:2013-01-01
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Size:11 pages
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ISSN:
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Type of media:Article (Journal)
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Type of material:Print
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Language:English
- New search for: 541 / 540
- Further information on Dewey Decimal Classification
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Classification:
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Source:
© Metadata Copyright the British Library Board and other contributors. All rights reserved.
Table of contents – Volume 117, Issue 20
The tables of contents are generated automatically and are based on the data records of the individual contributions available in the index of the TIB portal. The display of the Tables of Contents may therefore be incomplete.
- 6019
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PNP Diminishes Guanosine Glycosidic Bond Strength Through Restrictive Ring Pucker as a Precursor to PhosphorylationBarnett, Christopher B. / Naidoo, Kevin J. et al. | 2013
- 6027
-
Photoelectron Spectra of Some Important Biological Molecules: Symmetry-Adapted-Cluster Configuration Interaction StudyFarrokhpour, Hossein / Ghandehari, Maryam et al. | 2013
- 6042
-
Structural Comparison of the Wild-Type and Drug-Resistant Mutants of the Influenza A M2 Proton Channel by Molecular Dynamics SimulationsGu, Ruo-Xu / Liu, Limin Angela / Wang, Yong-Hua / Xu, Qin / Wei, Dong-Qing et al. | 2013
- 6052
-
Solid-State NMR Study of a 41 kDa Membrane Protein Complex DsbA/DsbBSperling, Lindsay J. / Tang, Ming / Berthold, Deborah A. / Nesbitt, Anna E. / Gennis, Robert B. / Rienstra, Chad M. et al. | 2013
- 6061
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Disentangling Electron Tunneling and Protein Dynamics of Cytochrome c through a Rationally Designed Surface MutationAlvarez-Paggi, Damián / Meister, Wiebke / Kuhlmann, Uwe / Weidinger, Inez / Tenger, Katalin / Zimányi, László / Rákhely, Gábor / Hildebrandt, Peter / Murgida, Daniel H. et al. | 2013
- 6069
-
A Novel Tri-Enzyme System in Combination with Laser-Driven NMR Enables Efficient Nuclear Polarization of Biomolecules in SolutionLee, Jung Ho / Cavagnero, Silvia et al. | 2013
- 6082
-
Oxygen Entry through Multiple Pathways in T‑State Human HemoglobinTakayanagi, Masayoshi / Kurisaki, Ikuo / Nagaoka, Masataka et al. | 2013
- 6092
-
New Insights into the Folding of a β‑Sheet Miniprotein in a Reduced Space of Collective Hydrogen Bond Variables: Application to a Hydrodynamic Analysis of the Folding FlowKalgin, Igor V. / Caflisch, Amedeo / Chekmarev, Sergei F. / Karplus, Martin et al. | 2013
- 6092
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New Insights into the Folding of a beta -Sheet Miniprotein in a Reduced Space of Collective Hydrogen Bond Variables: Application to a Hydrodynamic Analysis of the Folding FlowKalgin, I.V. / Caflisch, A. / Chekmarev, S.F. / Karplus, M. et al. | 2013
- 6106
-
Excited-State Structure and Dynamics of Keto–Amino Cytosine: The 1ππ* State Is Nonplanar and Its Radiationless Decay Is Not UltrafastLobsiger, Simon / Trachsel, Maria A. / Frey, Hans-Martin / Leutwyler, Samuel et al. | 2013
- 6116
-
Salting-in with a Salting-out Agent: Explaining the Cation Specific Effects on the Aqueous Solubility of Amino AcidsTomé, Luciana I. N. / Pinho, Simão P. / Jorge, Miguel / Gomes, José R. B. / Coutinho, João A. P. et al. | 2013
- 6129
-
Origin of Abrupt Rise in Deuteron NMR Longitudinal Relaxation Times of Protein Methyl Groups below 90 KVugmeyster, Liliya / Ostrovsky, Dmitry / Lipton, Andrew S. et al. | 2013
- 6138
-
Induced Dipoles Incorporated into All-Atom Zn Protein Simulations with Multiscale ModelingHuang, Yan-Dong / Shuai, Jian-Wei et al. | 2013
- 6149
-
Mapping Molecular Orientation with Phase Sensitive Vibrationally Resonant Sum-Frequency Generation MicroscopyHan, Yang / Raghunathan, Varun / Feng, Ran-ran / Maekawa, Hiroaki / Chung, Chao-Yu / Feng, Yuan / Potma, Eric O. / Ge, Nien-Hui et al. | 2013
- 6157
-
IRMPD Spectroscopic Study of Microsolvated [Na(GlyAla)]+ and [Ca(GlyAla–H)]+ and the Blue Shifting of the Hydrogen-Bonded Amide Stretch with Each Water AdditionMoghaddam, Maryam B. / Fridgen, Travis D. et al. | 2013
- 6165
-
Hydrodynamic Effects on the Relative Rotational Velocity of Associating ProteinsDługosz, Maciej / Antosiewicz, Jan M. et al. | 2013
- 6175
-
Molecular Mechanism of Misfolding and Aggregation of Aβ(13–23)Lovas, Sándor / Zhang, Yuliang / Yu, Junping / Lyubchenko, Yuri L. et al. | 2013
- 6175
-
Molecular Mechanism of Misfolding and Aggregation of A beta (13-23)Lovas, S. / Zhang, Y. / Yu, J. / Lyubchenko, Y.L. et al. | 2013
- 6187
-
The Influence of Rifabutin on Human and Bacterial Membrane Models: Implications for Its Mechanism of ActionPinheiro, Marina / Nunes, Cláudia / Caio, João M. / Moiteiro, Cristina / Lúcio, Marlene / Brezesinski, Gerald / Reis, Salette et al. | 2013
- 6194
-
DNA Bending Propensity in the Presence of Base Mismatches: Implications for DNA RepairSharma, Monika / Predeus, Alexander V. / Mukherjee, Shayantani / Feig, Michael et al. | 2013
- 6206
-
Single Point Mutation Alters the Microstate Dynamics of Amyloid β‑Protein Aβ42 as Revealed by Dihedral Dynamics AnalysesXu, Liang / Shan, Shengsheng / Wang, Xicheng et al. | 2013
- 6206
-
Single Point Mutation Alters the Microstate Dynamics of Amyloid beta -Protein A beta 42 as Revealed by Dihedral Dynamics AnalysesXu, L. / Shan, S. / Wang, X. et al. | 2013
- 6217
-
Electrostatic Effects on Proton Coupled Electron Transfer in Oxomanganese Complexes Inspired by the Oxygen-Evolving Complex of Photosystem IIAmin, Muhamed / Vogt, Leslie / Vassiliev, Serguei / Rivalta, Ivan / Sultan, Mohammad M. / Bruce, Doug / Brudvig, Gary W. / Batista, Victor S. / Gunner, M. R. et al. | 2013
- 6227
-
Sensitive Cu2+–Cu2+ Distance Measurements in a Protein–DNA Complex by Double-Quantum Coherence ESRRuthstein, Sharon / Ji, Ming / Mehta, Preeti / Jen-Jacobson, Linda / Saxena, Sunil et al. | 2013
- 6231
-
Intermediate Structures for Higher Level Arrangements: Catching Disk-Like Micelles in Decane Phosphonic Acid Aqueous SolutionsSchulz, Erica P. / Piñeiro, Ángel / Rodriguez, José L. / Minardi, Rosana M. / Frechero, Marisa / Schulz, Pablo C. et al. | 2013
- 6241
-
Effects of Surfactants on the Purple Membrane and Bacteriorhodopsin: Solubilization or Aggregation?Ng, Ka Chon / Chu, Li-Kang et al. | 2013
- 6250
-
Dynamics in Anionic Micelles: Effect of Phenyl RingSharma, V. K. / Mitra, S. / Johnson, M. / Mukhopadhyay, R. et al. | 2013
- 6256
-
Asymmetric Profiles and Prewetting Lines in the Filling of Planar Slits with NeSartarelli, Salvador A. / Szybisz, Leszek et al. | 2013
- 6269
-
Direct Absolute pK a Predictions and Proton Transfer Mechanisms of Small Molecules in Aqueous Solution by QM/MM-MDUddin, Nizam / Choi, Tae Hoon / Choi, Cheol Ho et al. | 2013
- 6276
-
Long-Range Hofmeister Effects of Anionic and Cationic AmphiphilesEnami, Shinichi / Colussi, Agustín J. et al. | 2013
- 6282
-
Simulation Study of the Initial Crystallization Processes of Poly(3-hexylthiophene) in Solution: Ordering Dynamics of Main Chains and Side ChainsTakizawa, Yuumi / Shimomura, Takeshi / Miura, Toshiaki et al. | 2013
- 6290
-
Anomaly of Pretransitional Behavior at the Nematic–Smectic‑A Phase Transition of Amphiphilic Liquid Crystals with a Hydrophilic GroupKimoto, Yasuhiro / Nishizawa, Ayumi / Takanishi, Yoichi / Yoshizawa, Atsushi / Yamamoto, Jun et al. | 2013
- 6294
-
Reversible Adsorption–Desorption Oscillations of Nanoparticles on a Patterned Hydrogel Surface Induced by a pH Oscillator in a Closed Chemical SystemKim, Jin Kyung / Kim, Kwang Il / Basavaraja, C. / Rabai, G. / Huh, Do Sung et al. | 2013
- 6304
-
Charge Delocalization through Benzene, Naphthalene, and Anthracene Bridges in π‑Conjugated Oligomers: An Experimental and Quantum Chemical StudyFraind, Alicia M. / Sini, Gjergji / Risko, Chad / Ryzhkov, Lev R. / Brédas, Jean-Luc / Tovar, John D. et al. | 2013
- 6318
-
Decoration of Microparticles by Highly Charged NanoparticlesHuang, Haohao / Ruckenstein, Eli et al. | 2013
- 6323
-
Confined Crystallization of n‑Hexadecane Located inside Microcapsules or outside Submicrometer Silica Nanospheres: A Comparison StudyFu, Dongsheng / Su, Yunlan / Gao, Xia / Liu, Yufeng / Wang, Dujin et al. | 2013
- 6330
-
Stability and Metastability of Bromine Clathrate PolymorphsNguyen, Andrew H. / Molinero, Valeria et al. | 2013