Uncategorized Archives - Page 28 of 164

Virtual {data|information} augmentation {method|technique|approach|strategy|system|process} for reaction prediction in {small|little|tiny|modest|smaller|compact} dataset {scenario|situation}

Chemexpress January 20, 2025 0 Comments

{To improve|To enhance} the {performance|overall performance|efficiency|functionality} of data-driven reaction prediction models, {a new|a brand new} {data|information} augmentation {method|technique|approach|strategy|system|process} for augmenting {data|information} volumes is presented that aims to add fake {data|information}…

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One-Pot Synthesis of Heteroatom-Bridged Cyclic Diaryliodonium Salts

Chemexpress January 20, 2025 0 Comments

Two one-pot procedures for the {construction|building} of O- and N-bridged diaryliodonium triflates are described. {An effective|An efficient} aryne-mediated arylation of o-iodophenols and sulfonamides {provides|offers|gives|supplies|delivers} diarylether and diarylamine intermediates, {which are|that…

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Oxygen tolerant RAFT polymerisation initiated by living bacteria

Chemexpress January 20, 2025 0 Comments

Living organisms can synthesize a wide {range of|selection of|array of} macromolecules from a {small|little|tiny|modest|smaller|compact} set of {natural|all-natural|organic} {building|developing|creating|constructing} blocks, {yet|however|but} {there is|there’s|there is certainly} {potential|possible|prospective} for even {greater|higher} {materials|supplies|components} diversity…

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{Development|Improvement} of {small|little|tiny|modest|smaller|compact} cyclic peptides targeting the CK2α/β interface

Chemexpress January 20, 2025 0 Comments

CK2 {is a|is really a|is actually a|can be a|is often a|is usually a} ubiquitous protein kinase, with {key|important|crucial|essential} roles {in the|within the|inside the} regulation of cell {growth|development} and proliferation. In…

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Assembly of unsymmetrical 1,{3|three},5-triarylbenzenes {via|by way of|through|by means of} tandem reaction of β-arylethenesulfonyl fluorides and α-cyano-β-methylenones

Chemexpress January 20, 2025 0 Comments

A transition-metal-free tandem reaction of β-arylethenesulfonyl fluorides and α-cyano-β-methylenones has been revealed. {In the|Within the|Inside the} presence of cesium carbonate, 2-arylethenesulfonyl fluorides react with α-cyano-β-methylenones {through|via|by means of|by way of}…

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Decorating beads with paramagnetic rings: synthesis of inorganic-organic [10^14]rotaxanes as shown by spin counting

Chemexpress January 19, 2025 0 Comments

Polymer beads {have been|happen to be|have already been} {used|utilized|employed|utilised|applied|made use of} {as the|because the} core of magnetic particles for {around|about} twenty years. {Here|Right here} we report {studies|research} to attach polymetallic…

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Time-Resolved Dynamics of {Stable|Steady} Open- and Closed-Shell Neutral Radical and Oxidized Tripyrrindione Complexes

Chemexpress January 19, 2025 0 Comments

{Stable|Steady} open- and closed-shell Pd(II) and Cu(II) complexes of hexaethyl tripyrrin-1,14-dione (TD1) {produce|create|generate|make} triplet, doublet or singlet states {depending|based} {on the|around the} metal center {and the|and also the|as well as…

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GenUI: Interactive and Extensible Open {Source|Supply} {Software|Software program|Computer software|Application} Platform for De Novo Molecular Generation

Chemexpress January 19, 2025 0 Comments

This manuscript describes the {development|improvement} and architecture {of the|from the|in the|on the|with the|of your} GenUI {software|software program|computer software|application} platform for integration of molecular generators. The {source|supply} code for the {components|elements}…

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A {Generally|Usually|Typically|Normally|Commonly|Frequently} Applicable Atomic-Charge Dependent London Dispersion Correction Scheme

Chemexpress January 19, 2025 0 Comments

The D4 model is presented for the {accurate|correct|precise} computation of London dispersion interactions in density functional theory approximations (DFT-D4) and {generally|usually|typically|normally|commonly|frequently} for atomistic modeling {methods|techniques|strategies|approaches|procedures|solutions}. {In this|Within this} successor {to…

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The pH-dependent Swelling of Weak Polyelectrolyte Hydrogels Modeled at {Different|Various|Distinct|Diverse|Unique|Distinctive} Levels of Resolution

Chemexpress January 19, 2025 0 Comments

The swelling of polyelectrolyte hydrogels has been {often|frequently|usually|typically|generally|normally} explained {using|utilizing|making use of|employing|working with|applying} {simple|easy|straightforward|basic|uncomplicated|very simple} models derived {from the|in the} Flory-Rehner model.{While|Whilst|Although|Even though|When|Though} these models qualitatively predict the experimentally observed…

Virtual {data|information} augmentation {method|technique|approach|strategy|system|process} for reaction prediction in {small|little|tiny|modest|smaller|compact} dataset {scenario|situation}

One-Pot Synthesis of Heteroatom-Bridged Cyclic Diaryliodonium Salts

Oxygen tolerant RAFT polymerisation initiated by living bacteria

{Development|Improvement} of {small|little|tiny|modest|smaller|compact} cyclic peptides targeting the CK2α/β interface

Assembly of unsymmetrical 1,{3|three},5-triarylbenzenes {via|by way of|through|by means of} tandem reaction of β-arylethenesulfonyl fluorides and α-cyano-β-methylenones

Decorating beads with paramagnetic rings: synthesis of inorganic-organic [10^14]rotaxanes as shown by spin counting

Time-Resolved Dynamics of {Stable|Steady} Open- and Closed-Shell Neutral Radical and Oxidized Tripyrrindione Complexes

GenUI: Interactive and Extensible Open {Source|Supply} {Software|Software program|Computer software|Application} Platform for De Novo Molecular Generation

A {Generally|Usually|Typically|Normally|Commonly|Frequently} Applicable Atomic-Charge Dependent London Dispersion Correction Scheme

The pH-dependent Swelling of Weak Polyelectrolyte Hydrogels Modeled at {Different|Various|Distinct|Diverse|Unique|Distinctive} Levels of Resolution

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