Search Results - "Král, Petr"

Computational Design of ACE2-Based Peptide Inhibitors of SARS-CoV‑2 by Han, Yanxiao, Král, Petr

“…Peptide inhibitors against the SARS-CoV-2 coronavirus, currently causing a worldwide pandemic, are designed and simulated. The inhibitors are mostly formed by…”
Get full text

Selective Ion Passage through Functionalized Graphene Nanopores by Sint, Kyaw, Wang, Boyang, Král, Petr

“…We design functionalized nanopores in graphene monolayers and show by molecular dynamics simulations that they provide highly selective passage of hydrated…”
Get full text

Supramolecular Control of Azobenzene Switching on Nanoparticles by Chu, Zonglin, Han, Yanxiao, Bian, Tong, De, Soumen, Král, Petr, Klajn, Rafal

“…The reversible photoisomerization of azobenzene has been utilized to construct a plethora of systems in which optical, electronic, catalytic, and other…”
Get full text

Nanodroplet Activated and Guided Folding of Graphene Nanostructures by Patra, Niladri, Wang, Boyang, Král, Petr

“…We demonstrate by molecular dynamics simulations that water nanodroplets can activate and guide the folding of planar graphene nanostructures. Once the…”
Get full text

Enantioselective Molecular Transport in Multilayer Graphene Nanopores by Yan, Youguo, Li, Wen, Král, Petr

“…Multilayer superstructures based on stacked layered nanomaterials offer the possibility to design three-dimensional (3D) nanopores with highly specific…”
Get full text

Three-step nucleation of metal–organic framework nanocrystals by Liu, Xiangwen, Chee, See Wee, Raj, Sanoj, Sawczyk, Michal, Král, Petr, Mirsaidov, Utkur

“…Metal–organic frameworks (MOFs) are crystalline nanoporous materials with great potential for a wide range of industrial applications. Understanding the…”
Get full text

Realistic cataloguing of nanopores by Král, Petr

“…Despite an enormous number of nanopores that could, in principle, be formed in atomically thin materials, advanced modelling reveals that in typical…”
Get full text

Hybridization of Biomolecular Crystals and Low-Dimensional Materials by Rehak, Pavel, Král, Petr

“…In cellular environments, metabolites, peptides, proteins, and other biomolecules can self-assemble into planar and fibrilar molecular crystals. We use…”
Get full text

Sandwiched Graphene−Membrane Superstructures by Titov, Alexey V, Král, Petr, Pearson, Ryan

“…We demonstrate by molecular dynamics simulations that graphene sheets could be hosted in the hydrophobic interior of biological membranes formed by amphiphilic…”
Get full text

Sulfoglycodendron Antivirals with Scalable Architectures and Activities by Coppola, Francesco, Jafari, Roya, McReynolds, Katherine D., Král, Petr

“…Many viruses initiate their cell-entry by binding their multisubunit receptors to human heparan sulfate proteoglycans (HSPG) and other molecular components…”
Get full text

Self-Assembly of Graphene Nanostructures on Nanotubes by Patra, Niladri, Song, Yuanbo, Král, Petr

“…We demonstrate by molecular dynamics simulations that carbon nanotubes can activate and guide on their surfaces and in their interiors the self-assembly of…”
Get full text

Self-Assembly of Aromatic Amino Acid Enantiomers into Supramolecular Materials of High Rigidity by Bera, Santu, Xue, Bin, Rehak, Pavel, Jacoby, Guy, Ji, Wei, Shimon, Linda J. W, Beck, Roy, Král, Petr, Cao, Yi, Gazit, Ehud

“…Most natural biomolecules may exist in either of two enantiomeric forms. Although in nature, amino acid biopolymers are characterized by l-type homochirality,…”
Get full text

Linker-Mediated Self-Assembly Dynamics of Charged Nanoparticles by Lin, Guanhua, Chee, See Wee, Raj, Sanoj, Král, Petr, Mirsaidov, Utkur

“…Using in situ liquid cell transmission electron microscopy (TEM), we visualized a stepwise self-assembly of surfactant-coated and hydrated gold nanoparticles…”
Get full text

Characterization of innovative rotary swaged Cu-Al clad composite wire conductors by Kocich, Radim, Kunčická, Lenka, Král, Petr, Strunz, Pavel

“…Cu/Al composites are perspective for applications in a wide range of industrial and commercial branches, from transportation to elecatrotechnics. This study…”
Get full text

An Organometallic Strategy for Assembling Atomically Precise Hybrid Nanomaterials by Stauber, Julia M, Qian, Elaine A, Han, Yanxiao, Rheingold, Arnold L, Král, Petr, Fujita, Daishi, Spokoyny, Alexander M

“…For decades, chemists have strived to mimic the intricate design and diverse functions of naturally occurring systems through the bioinspired synthesis of…”
Get full text

Linear One-Dimensional Assembly of Metal Nanostructures onto an Asymmetric Peptide Nanofiber with High Persistence Length by Mondal, Sudipta, Rehak, Pavel, Ghosh, Nandita, Král, Petr, Gazit, Ehud

“…Self-assembled peptide fibrils have been used extensively to template the organization of metal nanoparticles in a one-dimensional (1D) array. It has been…”
Get full text

Nanostructured Layered Cathode for Rechargeable Mg-Ion Batteries by Tepavcevic, Sanja, Liu, Yuzi, Zhou, Dehua, Lai, Barry, Maser, Jorg, Zuo, Xiaobing, Chan, Henry, Král, Petr, Johnson, Christopher S, Stamenkovic, Vojislav, Markovic, Nenad M, Rajh, Tijana

“…Nanostructured bilayered V2O5 was electrochemically deposited within a carbon nanofoam conductive support. As-prepared electrochemically synthesized bilayered…”
Get full text

Template-Free Hierarchical Self-Assembly of Iron Diselenide Nanoparticles into Mesoscale Hedgehogs by Deng, Dawei, Hao, Changlong, Sen, Soumyo, Xu, Chuanlai, Král, Petr, Kotov, Nicholas A

“…The ability of semiconductor nanoparticles (NPs) to self-assemble has been known for several decades. However, the limits of the geometrical and functional…”
Get full text

Reversible chromism of spiropyran in the cavity of a flexible coordination cage by Samanta, Dipak, Galaktionova, Daria, Gemen, Julius, Shimon, Linda J. W., Diskin-Posner, Yael, Avram, Liat, Král, Petr, Klajn, Rafal

“…Confining molecules to volumes only slightly larger than the molecules themselves can profoundly alter their properties. Molecular switches—entities that can…”
Get full text

Nanoparticle Conjugation Stabilizes and Multimerizes β‑Hairpin Peptides To Effectively Target PD-1/PD-L1 β‑Sheet-Rich Interfaces by Jeong, Woo-jin, Bu, Jiyoon, Han, Yanxiao, Drelich, Adam J, Nair, Ashita, Král, Petr, Hong, Seungpyo

“…β-Hairpin peptides present great potential as antagonists against β-sheet-rich protein surfaces, of which wide and flat geometries are typically “undruggable”…”
Get full text