Effect of Source-sink Change on Photosynthesis and Yield of Wheat

[Objective] The paper aims to explore the influences of source sink change of wheat at different densities on wheat yield.[Method] 225 （D1） and 320 plant/m2（D2） were adopted,then cutting flag leaf （L1）,the second last leaf （L2）,removing upper part of spike （L3） and controlling （CK） were used to conduct field experiment.[Result] The results showed that both of the two densities of wheat＇s 1 000-grain weight and grain filling rate after anthesis in a decreasing order of L3〉CK〉L2〉L1,and the grain weight per spike and dry matter amount translated after anthesis turned to be CK〉L2〉L1 〉L3.[Conclusion].Both of leaf-cutting and spikelet removing decreased the grain weight per spike and dry matter amount translated after anthesis.Removing upper part of spike increased wheat＇s 1 000-grain weight.But the decreasing of the sink and dry matter amount translated contributed to the decreasing of the yield of wheat.

Green aerobic oxidative desulfurization of diesel by constructing an Fe-Anderson type polyoxometalate and benzene sulfonic acid-based deep eutectic solvent biomimetic cycle

A unique redox-coupled biomimetic system was developed, in which Fe-Anderson type polyoxometalates(POMs) were employed as electron transfer mediators(ETMs) and benzenesulfonic acid(BSA)-based deep eutectic solvents(DESs) were used as electron-donors for aerobic oxidative desulfurization(AODS) of diesel fuel. Different compositions of DESs were used and the polyethylene glycol 2000(PEG2000)/2.5 BSA system showed the highest desulfurization activity, with the removal of dibenzothiophene(DBT) at 60 ℃ reaching 95% in 60 min. The excellent desulfurization activity of the system is due to the in situ formation of peroxysulfonate via a biomimetic process. By constructing a coupled redox system, Fe-Anderson type POMs as ETMs reduce the activation energy of oxygen-activated sulfonate. The physical characteristics of four different DESs were tested. The results show that the conductivity of DESs is correlated with the composition of BSA-based DESs. However, there is no similar trend in viscosity testing at the same temperature, and the maximum viscosity value is obtained for the PEG2000/2.5 BSA system at 60 ℃, which may be associated with the stronger hydrogen bonds. It is worth noting that the PEG2000/2.5 BSA system also possesses the best desulfurization activity, which suggests that the activity of the desulfurization system is related to the strength of the hydrogen bond in DESs. Finally, the biomimetic desulfurization system exhibits excellent performance and good stability under mild reaction conditions(60 ℃, atmospheric pressure, oxygen as the oxidant).

Regulation of Excited-State Intramolecular Proton Transfer Process and Photophysical Properties for Benzoxazole Isothiocyanate Fluorescent Dyes by Changing Atomic Electronegativity

Excited-state intramolecular proton transfer(ESIPT)is favored by researchers because of its unique optical properties.However,there are relatively few systematic studies on the effects of changing the electronegativity of atoms on the ESIPT process and photophysical properties.Therefore,we selected a series of benzoxazole isothiocyanate fluorescent dyes(2-HOB,2-HSB,and 2-HSe B)by theoretical methods,and systematically studied the ESIPT process and photophysical properties by changing the electronegativity of chalcogen atoms.The calculated bond angle,bond length,energy gap,and infrared spectrum analysis show that the order of the strength of intramolecular hydrogen bonding of the three molecules is 2-HOB<2-HSB<2-HSe B.Correspondingly,the magnitude of the energy barrier of the potential energy curve is 2-HOB>2-HSB>2-HSe B.In addition,the calculated electronic spectrum shows that as the atomic electronegativity decreases,the emission spectrum has a redshift.Therefore,this work will offer certain theoretical guidance for the synthesis and application of new dyes based on ESIPT properties.

Numerical modeling airflow in soil with impact of groundwater

In order to simulate the airflow in anhydrous case and the water-air flow in groundwater case, a numerical model of airflow in soil was developed. For the nonlinearity of the governing partial differential equation, the corresponding discretization and linearization methods were given. Due to the mass transfer between air-phase and water-phase, phase states of the model elements were constantly changing. Thus, parameters of the model were divided into primary ones and secondary ones, and the primary variables changing with phase states and the secondary variables can be obtained by their functional relationship with the primary variables. Additionally, the special definite condition of this numerical model was illustrated. Two examples were given to simulate the airflow in soil whether there was groundwater or not, and the effectiveness of the numerical model is verified by comparing the results of simulation with that of exoeriment.

Mechanistic Insights into the Photophysics of Ortho-hydroxyl GFP Core Chromophores

Herein we have employed the MS-CASPT2//CASSCF method to study the S1 excited-state intramolecular proton transfers （ESIPTs） of recently synthesized ortho-hydroxyl GFP core chromophores, i.e. OHIM, CHBDI, and MHBID, and their excited-state relaxation pathways. We have found that in OHIM and CHBDI, the ESIPT process is associated with small barriers of 3.4 and 4.2 kcal/mol; while, in MHBDI, it becomes essentially barrierless. Moreover, we have found two main S1 excited-state radiationless channels. In the first one, the enol S1 species decays to the So state via the enol S1/S0 conical intersection after overcoming considerable barriers of 7.0 and 7.7 kcal/mol in OHIM and CHBDI （however, in MHBDI, it is nearly barrierless）. In the second one, the keto S] species is first generated through the ESIPT event; then, it is de-excited into the So state in the vicinity of the keto S1/S0 conical intersection. These energetically allowed excited-state decay channels rationalize ex- perimentally observed ultralow fluorescence quantum yields. The insights gained from the present work may help to guide the design of new ortho-hydroxyl GFP core chromophores with improved fluorescence emission and brightness.

Effect of Solvent Polarity on Excited-State Double Proton Transfer Process of 1,5-Dihydroxyanthraquinone

The excited-state double proton transfer(ESDPT)properties of 1,5-dihydroxyanthraquinone(1,5-DHAQ)in various solvents were investigated using femtosecond transient absorption spectroscopy and the DFT/TDDFT method.The steady-state fluorescence spectra in toluene,tetrahydrofuran(THF)and acetonitrile(ACN)solvents presented that the solvent polarity has an effect on the position of the ESDPT fluorescence emission peak for the 1,5-DHAQ system.Transient absorption spectra show that the increasing polarity of the solvent accelerates the rate of excited state dynamics.Calculated potential energy curves analysis further verified the experimental results.The ESDPT barrier decreases gradually with the increase of solvent polarity from toluene,THF to ACN solvent.It is convinced that the increase of solvent polarity can promote the occurrence of the ESDPT dynamic processes for the 1,5-DHAQ system.This work clarifies the mechanism of the influence of solvent polarity on the ESDPT process of 1,5-DHAQ,which provides novel ideas for design and synthesis of new hydroxyanthraquinone derivatives.

Heat transfer of micro-droplet during free fall in drop tube

To explore the heat transfer of micro-droplet during free fall in the drop tube, the falling velocity and microgravity level are calculated. The Newtonian heat transfer formulation is coupled with the classical heat conduction equation to predict the heat transfer process within micro-droplet. Based on the numerical solution by finite difference method with implicit Euler scheme,the temporal evolution of thermal information inside micro-droplet is obtained including the temperature distribution, cooling rate, temperature difference and gradient. To quantitatively reveal the mechanism how the various factors affect the heat transfer of micro-droplet, the effects of physical properties of liquid metal and cooling gas as well as the micro-droplet size are studied.As the important indicators of heat transfer process, the cooling rate and temperature difference are acquired to systematically investigate the relationship between thermophysical properties and heat transfer process of different metallic micro-droplets.

Synthesis of Protein Nano-Conjugates for Cancer Therapy

A eukaryotic cell contains thousands of proteins that regulate its cellular function; delivering functional proteins into cells to rectify cellular functions holds great promise for treatment of various diseases, especially cancers. In this context, ribonuclease （RNase）, an enzyme that breaks down ribonucleic acid （RNA）, has great potential for cancer therapy. However, its therapeutic application is hampered by poor intracellular delivery efficiency and inhibition by ubiquitous intracellular RNase inhibitors. In this work, by designing and synthesizing RNase nano-conjugates by in situ atom transfer radical polymerization （ATRP）, we demonstrate a simple solution to address both challenges. Compared with native RNase, nano-conjugates exhibit significantly enhanced intracellular delivery efficiency, inhibitor resistance, and a near five-fold increase in cytotoxicity. This work provides a novel platform for delivery of therapeutic proteins for cancer therapy and other applications.

Analyzing excited-state processes and optical signatures of a ratiomeric fluorine anion sensor: a quantum look

Recently, the spectroscopic signatures of a benzoselenadiazole derivative have been investigated in the framework of designing a new ratiometric fluoride sensor （Saravanan et al., Org Lett, 2014, 16： 354-357）. It was suggested that this sensor is un- dergoing excited-state intramolecular proton transfer. In this work, we provide a new look at these experimental data, using a state-of-the-art time-dependent density fimctiona/theory approach to mimic the spectroscopic signatures. New insights about the nature of the excited-state processes are obtained.