Theoretical Investigation of the Fusion Process of Mono-Cages to Tri-Cages with CH4/C2H6 Guest Molecules in sI Hydrates

Owing to a stable and porous cage structure, natural gas hydrates can store abundant methane and serve as a potentially natural gas resource. However, the microscopic mechanism of how hydrate crystalline grows has not been fully explored, especially for the structure containing different guest molecules. Hence, we adopt density functional theory (DFT) to investigate the fusion process of structure I hydrates with CH4/C2H6 guest molecules from mono-cages to triple-cages. We find that the volume of guest molecules affects the stabilities of large (51262, L) and small (512, s) cages, which are prone to capture C2H6 and CH4, respectively. Mixed double cages (small cage and large cage) with the mixed guest molecules have the highest stability and fusion energy. The triangular triple cages exhibit superior stability because of the three shared faces, and the triangular mixed triple cages (large-small-large) structure with the mixed guest molecules shows the highest stability and fusion energy in the triple-cage fusion process. These results can provide theoretical insights into the growth mechanism of hydrates with other mono/mixed guest molecules for further development and application of these substances.

Raman Spectroscopic Study on a CO2-CH4-N2 Mixed-Gas Hydrate System

Accurate determination of the characteristics of coal mine gas separation products is the key for gas separation applications based on hydrate technology. Gas hydrates are synthesized from gases with two types of compositions (CO2-CH4-N2). The separation products were analyzed by in situ Raman spectroscopy. The crystal structure of the mixed-gas hydrate was determined, and the cage occupancy and hydration index were calculated based on the various vibrational modes of the molecules according to the “loose cage-tight cage” model and the Raman band area ratio combined with the van der Waals-Platteeuw model. The results show that the two mixed-gas hydrate samples both have a type I structure. Large cages of mixed-gas hydrate are mostly occupied by guest molecules, with large cage occupancies of 98.57 and 98.52%; however, small cages are not easy to occupy, with small cage occupancies of 29.93 and 33.87%. The average cage occupancies of these two hydrates are 81.41 and 82.36%, and the stability of the crystal structure of the mixed-gas hydrate in the presence of 75% CO2 is better than that of the mixed-gas hydrate in the presence of 70% CO2. The hydration indices of the two hydrate gas samples are 7.14 and 6.98, which are greater than the theoretical value of structure l.

Population suppression of the malaria vector Anopheles gambiae by gene drive technology: A large-cage indoor study bridging the gap between laboratory and field testing

CRISPR-based gene drives are self-sustaining genetic elements that have been recently generated in the laboratory with the aim to develop potent genetic vector control measures targeting disease vectors including Anopheles gambiae. We have shown that a gene drive directed against the gene doublesex (dsx) effectively suppressed the reproductive capability of mosquito populations reared in small laboratory cages. These experiments, though informative, do not recapitulate the complexity of mosquito behaviour in natural environments. Additional information is needed to bridge the gap between laboratory and the field to validate the vector control potential of the technology. We have investigated the suppressing activity of dsx gene drive strain Ag(QFS)1 on age-structured populations of Anopheles gambiae in large indoor cages that provide a more challenging ecology by more closely mimicking natural conditions and stimulating complex mosquito behaviours. Under these conditions, the Ag(QFS)1 drive spreads rapidly from a single release to the indoor large-cage populations at low initial frequency, leading to full population suppression within one year and without inducing resistance to the gene drive. Initial stochastic simulations of the expected population dynamics, as based on life history parameters estimated in small cages, did not fully capture the observed dynamics in the large cages. Thus, we used the method of approximate Bayesian computation to better estimate population dynamics in the more realistic ecological setting in large cages, allowing the mosquitoes to show a complex feeding and reproductive behaviour. Together, these results establish a new paradigm for generating data to bridge laboratory and field studies, and form an essential component in the stepwise and sound development of gene drive based vector control tools.

Effects of high-intensity interval training in more or less active mice on biomechanical, biophysical and biochemical bone parameters

High-intensity interval training (HIIT) is of scientific interest due its role in improving physical fitness, but the effects of HIIT on bone health need be carefully explored. Further, it is necessary to know whether HIIT effects on bone health are dependent on the physical activity levels. This may be experimentally tested since we have built a large cage (LC) that allows animals to move freely, promoting an increase of spontaneous physical activity (SPA) in comparison to a small cage (SC). Thus, we examined the effects of HIIT on biophysical, biomechanical and biochemical parameters of bone tissue of C57BL/6J mice living in cages of two different sizes: small (SC) or large (LC) cages with 1320 cm2 and 4800 cm2 floor space, respectively. Male mice were subdivided into two groups within each housing type: Control (C) and Trained (T). At the end of the interventions, all mice were euthanized to extract the femur bone for biophysical, biomechanical and biochemical analyses. Based a significant interaction from two-way ANOVA, trained mice kept in large cage (but not for trained mice housed in SC) exhibited a reduction of tenacity and displacement at failure in bone. This suggests that long-term HIIT program, in addition with a more active lifestyle correlates with exerts negative effects on the bone of healthy mice. A caution must also be raised about the excessive adoption of physical training, at least regarding bone tissue. On the other hand, increased calcium was found in femur of mice housed in LC. In line with this, LC-C mice were more active (i.e. SPA) than other groups. This implies that an active lifestyle without long-term high intensity physical training seems to play a role in promoting benefits to bone tissue. Our data provides new insights for treatment of osteo-health related disorders.

Social behavior of musk deer during the mating season potentially influences the diversity of their gut microbiome

An increasing body of research has revealed that social behavior shapes the animal gut microbiome community and leads to the similarity among the same social group. However, some additional factors (e.g., diet and habitat within each social group) may also contribute to this similarity within the social group and dissimilarity between social groups. Here, we investigated the potential correlation between social behavior and the gut microbiome community in 179 musk deer from four breeding regions in the Maerkang Captive Center, Sichuan. The dominant gut microbiome phyla in the musk deer in this study were Firmicutes, Bacteroidetes, and Proteobacteria. We found significant effects on the alpha and beta diversity of the gut microbiome due to the breeding regions. The similarity within breeding regions was higher than that between the breeding regions. Due to their solitary lifestyle, captive musk deer are raised in single cages with no direct social contact most of the time. Deer in all of the breeding regions have the same diet and similar living conditions. However, during each mating season from November to January, in each region, one adult male and about six adult females will be put together into a large cage. Social behavior happens during cohabitation, including mating behavior, grooming within the same sex or between different sexes, and other social contact. Therefore, we speculated that high similarity within the breeding region might be associated with the social behavior during the mating season. This was a simple and straightforward example of the relationship between animal social behavior and the gut microbiome.

A NEW LABORATORY COLONIZATION OF AEDES AEGYPTI AFTER REEMERGENCE AND UNSUCCESSFUL ERADICATION IN ST. AUGUSTINE, FLORIDA

After unsuccessful eradication attempts against Aedes aegypti (L.) following a sudden re-emergence in St. Augustine, Florida in early 2016; a new locally acquired colony strain of Ae. aegypti was established at the Anastasia Mosquito Control District (AMCD) in June 2017. Aedes aegypti adults were maintained in cages at the AMCD insectary. Larval and adult mosquitoes were collected from downtown St. Augustine, Florida. Female mosquitoes at 5-7 days old were fed upon the exposed forearm of human volunteers in the 1 st and 2 nd generations. Mating was observed in a large cage and confirmed with eggs deposited on wet filter paper in ovicups. Over 90% egg hatch was observed in the laboratory. The new colony strain of Ae. aegypti has been cataloged at the USDA, Center for Medical, Agricultural, and Veterinary Entomology facility in Gainesville, FL and is being used to further research and control this species across North Florida.

Investigating the Factors Affecting the Ionic Conduction in Nanoconfined NaBH4

Nanoconfinement is an effective strategy to tune the properties of the metal hydrides. It has been extensively employed to modify the ionic conductivity of LiBH4 as an electrolyte for Li-ion batteries. However, the approach does not seem to be applicable to other borohydrides such as NaBH4, which is found to reach a limited improvement in ionic conductivity of 10−7 S cm−1 at 115 °C upon nanoconfinement in Mobil Composition of Matter No. 41 (MCM-41) instead of 10−8 S cm−1. In comparison, introducing large cage anions in the form of Na2B12H12 naturally formed upon the nanoconfinement of NaBH4 was found to be more effective in leading to higher ionic conductivities of 10−4 S cm−1 at 110 °C.

Hydrogen Inter-Cage Hopping and Cage Occupancies inside Hydrogen Hydrate: Molecular-Dynamics Analysis

The inter-cage hopping in a type II clathrate hydrate with different numbers of H2 and D2 molecules, from 1 to 4 molecules per large cage, was studied using a classical molecular dynamics simulation at temperatures of 80 to 240 K. We present the results for the diffusion of these guest molecules (H2 or D2) at all of the different occupations and temperatures, and we also calculated the activation energy as the energy barrier for the diffusion using the Arrhenius equation. The average occupancy number over the simulation time showed that the structures with double and triple large-cage H2 occupancy appeared to be the most stable, while the small cages remained with only one guest molecule. A Markov model was also calculated based on the number of transitions between the different cage types.