Isostaticity and the solidification of semiflexible polymer melts

Using molecular dynamics simulations of a tangent-soft-sphere bead-spring polymer model, we examine the degree to which semiflexible polymer melts solidify at isostaticity. Flexible and stiff chains crystallize when they are isostatic as defined by appropriate degree-of-freedom-counting arguments. Semiflexible chains also solidify when isostatic if a generalized isostaticity criterion that accounts for the slow freezing out of configurational freedom as chain stiffness increases is employed. The dependence of the average coordination number at solidification $Z(T_s)$ on chains' characteristic ratio $C_\infty$ has the same functional form [$Z \simeq a - b\ln(C_\infty)$] as the dependence of the average coordination number at jamming $Z(\phi_J)$ on $C_\infty$ in athermal systems, suggesting that jamming-related phenomena play a significant role in thermal polymer solidification

Large expert-curated database for benchmarking document similarity detection in biomedical literature search

Document recommendation systems for locating relevant literature have mostly relied on methods developed a decade ago. This is largely due to the lack of a large offline gold-standard benchmark of relevant documents that cover a variety of research fields such that newly developed literature search techniques can be compared, improved and translated into practice. To overcome this bottleneck, we have established the RElevant LIterature SearcH consortium consisting of more than 1500 scientists from 84 countries, who have collectively annotated the relevance of over 180 000 PubMed-listed articles with regard to their respective seed (input) article/s. The majority of annotations were contributed by highly experienced, original authors of the seed articles. The collected data cover 76% of all unique PubMed Medical Subject Headings descriptors. No systematic biases were observed across different experience levels, research fields or time spent on annotations. More importantly, annotations of the same document pairs contributed by different scientists were highly concordant. We further show that the three representative baseline methods used to generate recommended articles for evaluation (Okapi Best Matching 25, Term Frequency-Inverse Document Frequency and PubMed Related Articles) had similar overall performances. Additionally, we found that these methods each tend to produce distinct collections of recommended articles, suggesting that a hybrid method may be required to completely capture all relevant articles. The established database server located at https://relishdb.ict.griffith.edu.au is freely available for the downloading of annotation data and the blind testing of new methods. We expect that this benchmark will be useful for stimulating the development of new powerful techniques for title and title/abstract-based search engines for relevant articles in biomedical research.Peer reviewe

High Areal Capacity and Sustainable High Energy in Ferroelectric Doped Holey Graphene/Sulfur Composite Cathode for Lithium-Sulfur Batteries

In this study, we are reporting the impact of the incorporation of ferroelectric nanoparticles (FNPs), such as BaTiO3 (BTO), BiFeO3 (BFO), Bi4NdTi3Fe0.7Ni0.3O15 (BNTFN), and Bi4NdTi3Fe0.5Co0.5O15 (BNTFC), as well as the mass loading of sulfur to fabricated solvent-free sulfur/holey graphene-carbon black/polyvinylidene fluoride (S/FNPs/CBhG/PVDF) composite electrodes to achieve high areal capacity for lithium-sulfur (Li-S) batteries. The dry-press method was adopted to fabricate composite cathodes. The hG, a conductive and lightweight scaffold derived from graphene, served as a matrix to host sulfur and FNPs for the fabrication of solvent-free composites. Raman spectra confirmed the dominant hG framework for all the composites, with strong D, G, and 2D bands. The surface morphology of the fabricated cathode system showed a homogeneous distribution of FNPs throughout the composites, confirmed by the EDAX spectra. The observed Li+ ion diffusion coefficient for the composite cathode started at 2.17 × 10−16 cm2/s (S25(CBhG)65PVDF10) and reached up to the highest value (4.15 × 10−15 cm2/s) for S25BNTFC5(CBhG)60PVDF10. The best discharge capacity values for the S25(CBhG)65PVDF10 and S25BNTFC5(CBhG)60PVDF10 composites started at 1123 mAh/gs and 1509 mAh/gs and dropped to 612 mAh/gs and 572 mAh/gs, respectively, after 100 cycles; similar behavior was exhibited by the other composites that were among the best. These are better values than those previously reported in the literature. The incorporation of ferroelectric nanoparticles in the cathodes of Li-S batteries reduced the rapid formation of polysulfides due to their internal electric fields. The areal capacity for the S25(CBhG)65PVDF10 composites was 4.84 mAh/cm2 with a mass loading of 4.31 mgs/cm2, while that for the S25BNTFC5(CBhG)60PVDF10 composites was 6.74 mAh/cm2 with a mass loading of 4.46 mgs/cm2. It was confirmed that effective FNP incorporation within the S cathode improves the cycling response and stability of cathodes, enabling the high performance of Li-S batteries

The impact of surgical delay on resectability of colorectal cancer: An international prospective cohort study

AimThe SARS-CoV-2 pandemic has provided a unique opportunity to explore the impact of surgical delays on cancer resectability. This study aimed to compare resectability for colorectal cancer patients undergoing delayed versus non-delayed surgery.MethodsThis was an international prospective cohort study of consecutive colorectal cancer patients with a decision for curative surgery (January-April 2020). Surgical delay was defined as an operation taking place more than 4 weeks after treatment decision, in a patient who did not receive neoadjuvant therapy. A subgroup analysis explored the effects of delay in elective patients only. The impact of longer delays was explored in a sensitivity analysis. The primary outcome was complete resection, defined as curative resection with an R0 margin.ResultsOverall, 5453 patients from 304 hospitals in 47 countries were included, of whom 6.6% (358/5453) did not receive their planned operation. Of the 4304 operated patients without neoadjuvant therapy, 40.5% (1744/4304) were delayed beyond 4 weeks. Delayed patients were more likely to be older, men, more comorbid, have higher body mass index and have rectal cancer and early stage disease. Delayed patients had higher unadjusted rates of complete resection (93.7% vs. 91.9%, P = 0.032) and lower rates of emergency surgery (4.5% vs. 22.5%, P ConclusionOne in 15 colorectal cancer patients did not receive their planned operation during the first wave of COVID-19. Surgical delay did not appear to compromise resectability, raising the hypothesis that any reduction in long-term survival attributable to delays is likely to be due to micro-metastatic disease

Large expert-curated database for benchmarking document similarity detection in biomedical literature search

Document recommendation systems for locating relevant literature have mostly relied on methods developed a decade ago. This is largely due to the lack of a large offline gold-standard benchmark of relevant documents that cover a variety of research fields such that newly developed literature search techniques can be compared, improved and translated into practice. To overcome this bottleneck, we have established the RElevant LIterature SearcH consortium consisting of more than 1500 scientists from 84 countries, who have collectively annotated the relevance of over 180 000 PubMed-listed articles with regard to their respective seed (input) article/s. The majority of annotations were contributed by highly experienced, original authors of the seed articles. The collected data cover 76% of all unique PubMed Medical Subject Headings descriptors. No systematic biases were observed across different experience levels, research fields or time spent on annotations. More importantly, annotations of the same document pairs contributed by different scientists were highly concordant. We further show that the three representative baseline methods used to generate recommended articles for evaluation (Okapi Best Matching 25, Term Frequency-Inverse Document Frequency and PubMed Related Articles) had similar overall performances. Additionally, we found that these methods each tend to produce distinct collections of recommended articles, suggesting that a hybrid method may be required to completely capture all relevant articles. The established database server located at https://relishdb.ict.griffith.edu.au is freely available for the downloading of annotation data and the blind testing of new methods. We expect that this benchmark will be useful for stimulating the development of new powerful techniques for title and title/abstract-based search engines for relevant articles in biomedical science. © The Author(s) 2019. Published by Oxford University Press