NMR-Based Configurational Assignments of Natural Products: Gibbs Sampling and Bayesian Inference Using Floating Chirality Distance Geometry Calculations

Floating chirality restrained distance geometry (fc-rDG) calculations are used to directly evolve structures from NMR data such as NOE-derived intramolecular distances or anisotropic residual dipolar couplings (RDCs). In contrast to evaluating pre-calculated structures against NMR restraints, multiple configurations (diastereomers) and conformations are generated automatically within the experimental limits. In this report, we show that the “unphysical” rDG pseudo energies defined from NMR violations bear statistical significance, which allows assigning probabilities to configurational assignments made that are fully compatible with the method of Bayesian inference. These “diastereomeric differentiabilities” then even become almost independent of the actual values of the force constants used to model the restraints originating from NOE or RDC data.     

汽车变速器齿轮修形仿真分析

汽车变速器的关键部件齿轮因其加工和装配质量的影响,工作时容易引起振动噪声大及承载能力降低等问题,而齿轮修形是解决这些问题的有效方法,且成本较低。针对某款汽车变速器,利用Romax对齿轮进行修形分析。结果表明,修形后减小了齿轮的传动误差和最大接触应力,齿面载荷分布更加合理。有效改善了齿轮的传动性能,增加了齿轮寿命。     

Simulation of transpiration, drainage, N uptake, nitrate leaching, and N uptake concentration in tomato grown in open substrate

Free-drainage or “open” substrate system used for vegetable production in greenhouses is associated with appreciable NO₃⁻ leaching losses and drainage volumes. Simulation models of crop N uptake, N leaching, water use and drainage of crops in these systems will be useful for crop and water resource management, and environmental assessment. This work (i) modified the TOMGRO model to simulate N uptake for tomato grown in greenhouses in SE Spain, (ii) modified the PrHo model to simulate transpiration of tomato grown in substrate and (iii) developed an aggregated model combining TOMGRO and PrHo to calculate N uptake concentrations and drainage NO₃⁻ concentration. The component models simulate NO₃⁻-N leached by subtracting simulated N uptake from measured applied N, and drainage by subtracting simulated transpiration from measured irrigation. Three tomato crops grown sequentially in free-draining rock wool in a plastic greenhouse were used for calibration and validation. Measured daily transpiration was determined by the water balance method from daily measurements of irrigation and drainage. Measured N uptake was determined by N balance, using data of volumes and of concentrations of NO₃⁻ and NH₄⁺ in applied nutrient solution and drainage. Accuracy of the two modified component models and aggregated model was assessed by comparing simulated to measured values using linear regression analysis, comparison of slope and intercept values of regression equations, and root mean squared error (RMSE) values. For the three crops, the modified TOMGRO provided accurate simulations of cumulative crop N uptake, (RMSE = 6.4, 1.9 and 2.6% of total N uptake) and NO₃⁻-N leached (RMSE = 11.0, 10.3, and 6.1% of total NO₃⁻-N leached). The modified PrHo provided accurate simulation of cumulative transpiration (RMSE = 4.3, 1.7 and 2.4% of total transpiration) and cumulative drainage (RMSE = 13.8, 6.9, 7.4% of total drainage). For the four cumulative parameters, slopes and intercepts of the linear regressions were mostly not statistically significant (P < 0.05) from one and zero, respectively, and coefficient of determination (r²) values were 0.96-0.98. Simulated values of total drainage volumes for the three crops were +21, +1 and −13% of measured total drainage volumes. The aggregated TOMGRO-PrHo model generally provided accurate simulation of crop N uptake concentration after 30-40 days of transplanting, with an average RMSE of approximately 2 mmol L⁻¹. Simulated values of average NO₃⁻ concentration in drainage, obtained with the aggregated model, were −7, +18 and +31% of measured values.     

黑龙江省农机购置补贴工作实施成效及建议

介绍近几年黑龙江省农机购置补贴工作的实施措施和成效,指出购机补贴工作中存在的问题．并对今后的农机购置补贴工作提出几点建议,以促进全省农机结构更加趋向合理化,推动农业机械化水平进一步提高,实现粮食增产、农业增效、农民增收。     

The Rht13 dwarfing gene reduces peduncle length and plant height to increase grain number and yield of wheat

The green-revolution Rht-B1b and Rht-D1b dwarfing alleles are usually associated with increased wheat yields but are linked to reduced early growth and poor emergence if sowing conditions are unfavourable. Other dwarfing genes are available but not used in commercial breeding. The Rht13 bread wheat donor, Magnif M1, produces uniquely short peduncle and penultimate internodes to reduce plant height. A set of near-isogenic (NILs) and recombinant inbred (RILs) lines varying for height were developed from the cross of Magnif M1 and the Rht8c-containing Chuan-mai 18, and evaluated for a range of agronomic characteristics across favourable environments. Reductions in plant height were associated with increased grain number (r² = 0.35**) and harvest index (r² = 0.62**) in the NILs. Reduced-height RILs containing the Rht13-linked, Xgwm577_M microsatellite marker were significantly shorter, produced greater biomass, yield and harvest index, and increased spike and grain number than lines without the marker. Approximately 74 and 7% of the total phenotypic variance in plant height was accounted for by allelic differences in Xgwm577 and Rht8 loci, respectively. The peduncle and penultimate peduncle internodes of Rht13-containing lines were proportionately shorter than Rht8c-containing sibs and lines containing the Rht-B1b dwarfing allele. The unique height-reducing phenotype, increased grain number and yield associated with Rht13 indicate considerable potential for use of this dwarfing allele for improving wheat performance.     

玉米自交系株型和产量性状的关系及其利用研究

以15个自交系为材料,按P(P-1)/2双列杂交设计,研究了株型和产量性状的遗传与相关.结果表明,近年育成的自交系,一般配合力有一定的改进,产量性状的一般配合力有明显的提高,各性状的一般配合力在亲本间存在显著差异.产量的一般配合力与单株叶数和穗粗的一般配合力存在极显著正相关。     

Visual FoxPro中错误处理技术

论述了Visual FoxPro程序设计过程中经常出现的错误,分析问题产生的原因并给出相应的解决办法.     

刚柔耦合串联机械臂末端位置误差分析与补偿

机械臂连杆柔性、关节柔性等非线性变形的综合影响,导致其末端位置发生偏离而产生误差。本文以IRB1410型串联机械臂为研究对象,采用理论分析、仿真分析与实验验证相结合的方式,对机械臂末端位置误差进行分析与补偿研究。首先,建立机械臂刚柔耦合理论误差模型,并运用Newmarkβ法进行数值仿真分析;联合ANSYS和ADAMS进行刚柔耦合机械臂末端位置运动误差仿真;为了实现快速补偿,提出基于BP神经网络的伪目标点法对位置误差进行补偿,补偿后其位置误差均方根减小了68.3%,说明该方法具有较好的补偿效果;最后,自主设计并搭建了测量实验平台,采用所提算法进行了误差补偿实验,对比补偿前后距离误差,补偿后误差均方根减小了77.01%,验证了伪目标点法对柔性误差补偿的有效性。     

不同施肥措施及复垦年限下土壤团聚体的大小分布及其稳定性

土壤团聚体的数量和质量直接影响着土壤性质和有机碳固存。研究长期不同施肥措施及复垦年限对采煤塌陷区土壤团聚体的重量分布比例及其稳定性的影响,为该区域的农业生产和土壤质量提升提供科学依据。采集复垦6年和11年定位试验不同施肥处理耕层土样,选取不施肥(CK)、平衡施氮磷钾肥(NPK)、单施有机肥(M)、有机无机肥配施(MNPK)4个处理,利用干筛法和湿筛法获得4种粒径的团聚体/粉黏粒组分(> 2 mm、0.25-2 mm、0.053-0.25 mm和< 0.053 mm),用> 0.25 mm团聚体含量(R_0.25)、平均重量直径(MWD)、团聚体破坏率(PAD)和土壤不稳定团粒指数(E_LT)表示团聚体的稳定性,并测定了土壤有机碳含量。结果表明：复垦年限对土壤团聚体的含量及稳定性影响产生了显著影响。干筛条件下,复垦6年和11年均显著降低了各处理0.053-0.25 mm团聚体和< 0.053 mm组分的含量,降幅分别为68.39%-87.37%、69.63%-78.32%(6年)和90.01%-93.68%、78.29%-83.93%(11年);湿筛条件下,复垦11年显著提高了各处理> 2 mm团聚体的含量,增幅达473.35%-645.16%,但是显著降低了0.053-0.25 mm团聚体的含量,降幅为43.67%-57.54%。土壤团聚体的稳定性也随着复垦年限的增加而逐渐增强,表现为DR_0.25、WR_0.25和MWD值呈增加趋势,而PAD和E_LT值呈降低趋势。土壤有机碳含量与DR_0.25、WR_0.25、MWD_水稳性呈极显著正相关关系,而它与PAD和E_LT呈极显著负相关关系。本研究表明,该区域连续复垦11年提高了土壤大团聚体的含量而伴随着微团聚体含量的显著减少,导致土壤结构越来越稳定。它对提高采煤塌陷区复垦土壤肥力、改善土壤结构效果最佳。     

自然水体中超声波标记鱼游动轨迹精密确定算法

针对鱼类关键生境位置确定的应用需求,该文提出了一套适用于自然水体的超声波标记鱼定位算法,解决了标记鱼定位以及存在粗差观测值,即水听器记录的超声波信号接收时间存在错误情况下算法的抗干扰性。宜昌黄柏河的实测结果表明,基于现有1 ms级精度的水听器,可在自然水体中获得2.15 m精度的信号标记鱼三维游动轨迹。如因气泡、遮挡等因素对水听器观测数据引入粗差,当粗差量级在10 m以上,该方法可接近100%探测出是否存在粗差。当粗差观测值在3个以内时,该方法的探测成功率可达84.3%以上,3个以上时粗差探测成功率明显下降,5个及以上,即粗差观测值个数占观测值总数的比例大于31.25%时,基本只能探测出观测数据中存在粗差而无法有效确定粗差。该研究可为渔业增殖、鱼类栖息地保护、鱼类洄游通道等研究提供参考。