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Gaussian Job Archive for C42H46N6O6

Henry S. Rzepa2015-01-01Figshare

Archive of work produced using the resources of the Imperial College High Performance Computing Service.

Photochromic and Fluorescence Chemistrybioluminescence and chemiluminescence research

Gaussian Job Archive for C6H20O8

Henry S. Rzepa2015-01-01Figshare

Archive of work produced using the resources of the Imperial College High Performance Computing Service.

Solid-state spectroscopy and crystallographyAdvanced NMR Techniques and ApplicationsNuclear Physics and Applications

Figure 4

Victor Gurewich2015-01-01Figshare

Fig 4. Lytic effect of range of tPA doses in presence of fixed low-dose M5

Engineering and Material Science Research

Gaussian Job Archive for C44H70N4O7Zn2 - 104128

Charles Romain2015-01-01Figshare

JobID 104128 Archive of work produced using the resources of the Imperial College High Performance Computing Service.

Fluorine in Organic ChemistrySynthesis and Reactions of Organic CompoundsLanthanide and Transition Metal Complexes

AMASED Second Phase (Jisc Data Spring Sandpit 2)

Becca Wilson、Paul J. Burton2015-01-01Figshare

Materials for Jisc sandpit 2: AMASED project bid for second phase funding. Project Rationale and phase 1 plan, costings and pitch are available at http://dx.doi.org/10.6084/m9.figshare.1319503

Material Selection and PropertiesCO2 Sequestration and Geologic InteractionsSpacecraft and Cryogenic Technologies

Contrast detection of regular sparse micro-patterns requires spatial templates for texture density

Daniel H. Baker2015-01-01Figshare

Data from a study in which we measured detection thresholds for periodic patterns with different Mark:Space ratios. Each block of data in the spreadsheet contains raw staircase data (number of correct trials and total number of trials at a range of contrast levels) for four repetitions of a single condition. Threshold…

3D Shape Modeling and AnalysisTextile materials and evaluationsIndustrial Vision Systems and Defect Detection

Nanocomposites Based on Chitosan-Graft-Poly(N-Vinyl-2-Pyrrolidone): Synthesis, Characterization, and Biological Activity

Mohamed S. Abdel Aziz、Hala F. Naguib、Gamal R. Saad2015-01-01Figshare

Organophilic montmorillonite (OMMT) was synthesized by cationic exchange between Na+-MMT and N-octyl-N-vinyl-2-pyrrolidonium bromide. Chitosan graft copolymer nanocomposites were synthesized by grafting N-vinyl-2-pyrrolidone onto chitosan in aqueous acetic acid in the presence of OMMT using free radical polymerization…

Bone Tissue Engineering MaterialsSynthesis of Tetrazole DerivativesNanoparticle-Based Drug Delivery

Supplementary Table 3.9.xlsx

Pallab Bhowmick2015-01-01Figshare

These are supporting information related to PhD thesis. All rights reserved © 2015 Pallab Bhowmick Apart from any fair dealing for the purposes of research, private study, criticism or review, this publication may not be reproduced, stored in a retrieval system, or transmitted in any form or by any means (electronic,…

Muon and positron interactions and applicationsRare-earth and actinide compoundsElectron and X-Ray Spectroscopy Techniques

First-time-in-Man EGFR targeted minicells

Himanshu Brahmbhatt2015-01-01Figshare

To examine the safety of the minicell delivery system, a first-time-in-human, open-label, phase I clinical study epidermal growth factor receptor (EGFR)-targeted, paclitaxel-loaded minicells (EGFR-minicells-Pac) was conducted in patients with advanced solid tumors. Patients received 5 weekly infusions followed by a tr…

Advanced MRI Techniques and ApplicationsLanthanide and Transition Metal ComplexesMedical Imaging Techniques and Applications

Mesophase behaviour of laterally di-fluoro-substituted four-ring compounds

Hoda A. Ahmed、Gamal R. Saad2015-01-01Figshare

Four new groups of the di-fluoro-substituted 4-(2′-(or 3′)-fluoro phenylazo)-2-(or 3-) fluoro phenyl-4″-alkoxyphenylazo benzoates (In–IVn) were prepared and investigated for their mesophase behaviour. An alkoxy group of variable chain length (n = 6, 10 and 14 carbons) is attached to the terminal phenylazo benzoate moi…

Liquid Crystal Research AdvancementsFluorine in Organic ChemistrySynthesis and properties of polymers

Interaction Between EPTAC-Modified Gelatin and Surfactants: Surface Tension and Conductivity Methods

Shuxia Liu、Xiaodeng Yang、Shijie Wang 等 6 位作者2015-01-01Figshare

Gelatin, one of the most valuable macromolecules and by-products of the leather industry, was modified by the addition of 2,3-epoxypropyl trimethyl ammonium chloride (EPTAC). The interaction between EPTAC-modified gelatin (EPTAC-gelatin) and cetyltrimethyl ammonium bromide (CTAB) or sodium dodecyl benzene sulfonate (S…

Polymer Nanocomposites and Properties

EM DQ8_001.PDB

Jurgen van Heemst2015-01-01Figshare

DQ8-DERAA complex. for more details: see note

Copper Interconnects and Reliability

Grid convergence of PyGBe with immunoglobulin G near a charged surface

Christopher D. Cooper、Lorena A. Barba2015-01-01Figshare

This file bundgle contains data, running script and final plot of grid-convergence study for immunoglobulin G near a charged surface. The running script invokes the bioelectrostatics solver (PyGBe) with the given input data, computes the extrapolated value of solvation plus surface energy (with Richardson extrapolatio…

Semiconductor Quantum Structures and DevicesLiquid Crystal Research Advancements

Gaussian Job Archive for ClH5O6

Henry S. Rzepa2015-01-01Figshare

Archive of work produced using the resources of the Imperial College High Performance Computing Service.

Solid-state spectroscopy and crystallographyAtomic and Subatomic Physics ResearchSpectroscopy and Laser Applications

Advantages of complex scaling only the most diffuse basis functions in simultaneous description of both resonances and bound states

Arie Landau、Idan Haritan、Petra Ruth Kaprálová-Žďánská 等 4 位作者2015-01-01Figshare

An accurate description of both bound and resonance states is desirable in the study of molecules. However, it is not a trivial task to accomplish, as theoretical and numerical formalisms developed for describing one do not always fit for describing the other. One such formalism, mainly designed to describe resonances…

Advanced Physical and Chemical Molecular InteractionsSolid-state spectroscopy and crystallographyAdvanced Chemical Physics Studies

NanoPUZZLES ISA-TAB-Nano dataset: Data reported in Shaw et al. 2008 (DOI:10.1073/pnas.0802878105)

Richard Marchese Robinson、Antonio Cassano2015-01-01Figshare

This file is a ZIP archive which contains three different copies of an ISA-TAB-Nano dataset developed within the NanoPUZZLES EU project [http://www.nanopuzzles.eu]. The (meta)data in this dataset were primarily extracted from the following reference, with additional references consulted as indicated in the Investigati…

Machine Learning in Materials Science