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| 1 | A general-purpose machine learning framework for predicting properties of inorganic materials显示文摘A very active area of materials research is to devise methods that use machine learning to automatically extract predictive models from existing materials data.While prior examples have demonstrated successful models for some applications,many more applications exist where machine learning can make a strong impact.To enable faster development of machine-learning-based models for such applications,we have created a framework capable of being applied to a broad range of materials data.Our method works by using a chemically diverse list of attributes,which we demonstrate are suitable for describing a wide variety of properties,and a novel method for partitioning the data set into groups of similar materials to boost the predictive accuracy.In this manuscript,we demonstrate how this new method can be used to predict diverse properties of crystalline and amorphous materials,such as band gap energy and glass-forming ability. | Logan Ward Ankit Agrawal Alok Choudhary Christopher Wolverton | 2016 | npj Computational Materials2016，，1： | 83 |
| 2 | Pseudoaneurysm of profunda femoris artery following dynamic hip screw fixation for intertrochanteric femoral fracture显示文摘动态新潮的螺丝钉固定是为 intertrochanteric 的内部固定的一个通常执行的过程大腿骨的破裂。跟随起作用的固定的动脉的损害是一个稀罕却严肃的事件。我们在场与一个动态新潮的螺丝钉在 intertrochanteric 骨折的内部固定以后开发了 profunda femoris 动脉的 pseudoaneurysm 的一个病人。诊断被 angiographic 学习证实,它被卷 embolization 成功地对待。 | Shailendra Singh Sumit Arora Ankit Thora Ram Mohan, Sumit Sural Anti Dhal | 2013 | Chinese Journal of Traumatology2013，16，4： | 13 |
| 3 | The joint automated repository for various integrated simulations (JARVIS) for data-driven materials design显示文摘The Joint Automated Repository for Various Integrated Simulations(JARVIS)is an integrated infrastructure to accelerate materials discovery and design using density functional theory(DFT),classical force-fields(FF),and machine learning(ML)techniques.JARVIS is motivated by the Materials Genome Initiative(MGI)principles of developing open-access databases and tools to reduce the cost and development time of materials discovery,optimization,and deployment. | Kamal Choudhary Kevin F.Garrity Andrew C.E.Reid Brian DeCost Adam J.Biacchi Angela R.Hight Walker Zachary Trautt Jason Hattrick-Simpers A.Gilad Kusne Andrea Centrone Albert Davydov Jie Jiang Ruth Pachter Gowoon Cheon Evan Reed Ankit Agrawal Xiaofeng Qian Vinit Sharma Houlong Zhuang Sergei V.Kalinin Bobby G.Sumpter Ghanshyam Pilania Pinar Acar Subhasish Mandal Kristjan Haule David Vanderbilt Karin Rabe Francesca Tavazza | 2020 | npj Computational Materials2020，，1： | 10 |
| 4 | Recent advances and applications of deep learning methods in materials science显示文摘Deep learning(DL)is one of the fastest-growing topics in materials data science,with rapidly emerging applications spanning atomistic,image-based,spectral,and textual data modalities.DL allows analysis of unstructured data and automated identification of features.The recent development of large materials databases has fueled the application of DL methods in atomistic prediction in particular.In contrast,advances in image and spectral data have largely leveraged synthetic data enabled by high-quality forward models as well as by generative unsupervised DL methods.In this article,we present a high-level overview of deep learning methods followed by a detailed discussion of recent developments of deep learning in atomistic simulation,materials imaging,spectral analysis,and natural language processing.For each modality we discuss applications involving both theoretical and experimental data,typical modeling approaches with their strengths and limitations,and relevant publicly available software and datasets.We conclude the review with a discussion of recent cross-cutting work related to uncertainty quantification in this field and a brief perspective on limitations,challenges,and potential growth areas for DL methods in materials science. | Kamal Choudhary Brian DeCost Chi Chen Anubhav Jain Francesca Tavazza Ryan Cohn Cheol Woo Park Alok Choudhary Ankit Agrawal Simon J.L.Billinge Elizabeth Holm Shyue Ping Ong Chris Wolverton | 2022 | npj Computational Materials2022，，1： | 9 |
| 5 | Optimizing submerged arc welding using response surface methodology, regression analysis, and genetic algorithm显示文摘The weld quality is significantly affected by the weld parameters(arc voltage, welding current, nozzle to plate distance and welding speed) in the submerged arc welding(SAW). Bead-on-plate welds were performed on stainless steel plates by automated SAW machine. The experimental data were collected in accordance with the response surface methodology(RSM). In addition to RSM, the regression analysis was performed to set up inputeoutput relationships in the SAW process. It was found that weld parameters define the geometry of weld bead and determine the mechanical properties of the joint. The influence of the input variables on weld bead geometry is represented as graphs. It was found that an increment in voltage increases the bead width but decreases the bead height, whereas the current increment result-in an increment in bead height and no change in bead width. The bead width and height decrease with the increment in the welding speed. With an increment in the nozzle-to-plate distance, bead width decrease, but bead height increases. The value of bead hardness increases with the increment in current but the increment in voltage and travel speed does not have a significant influence on the bead hardness. The predictions from the mathematical model developed and the corresponding experimental results are having a fair agreement. Further, the genetic algorithm(GA) is also used for predicting the weld bead geometry. | Ajitanshu Vedrtnam Gyanendra Singh Ankit Kumar | 2018 | Defence Technology(防务技术)2018，14，3： | 7 |
| 6 | Detecting prostate cancer and prostatic calcifications using advanced magnetic resonance imaging显示文摘前列腺癌症和 prostatic 石灰化在老人有高发生。我们试图在检测前列腺癌症和 prostatic 石灰化调查危险性加权的成像的诊断能力。156 个人的一个全部的数字,与前列腺癌症包括 34 并且 122 在这研究与良性的前列腺被注册。计算断层摄影术,常规磁性的回声成像,散开加权的成像,和危险性加权的成像在所有病人上被执行。112 prostatic 石灰化在 87 个病人被检测。常规磁性的回声成像,明显的散开系数,和在检测前列腺癌症和 prostatic 石灰化的过滤危险性的阶段图象的敏感和特性是计算的。McNemars Chi 平方测试被用来在在这些技术之间的敏感和特性比较差别。结果证明在检测 prostatic 癌症的过滤危险性的阶段图象的敏感和特性比常规磁性的回声成像和明显的散开系数的大(P < 0.05 ) 。另外,在检测 prostatic 石灰化的过滤危险性的阶段图象的敏感和特性比得上计算断层摄影术的并且比常规磁性的回声成像和明显的散开系数的大(P < 0.05 ) 。在前列腺癌症给危险性加权的成像(SWI ) 的高发生反常,我们断定危险性加权的成像在检测前列腺癌症比常规磁性的回声成像,散开加权的成像,和计算断层摄影术更敏感、特定。而且,危险性加权的成像能识别类似于计算断层摄影术的 prostatic 石灰化,并且它比常规磁性的回声成像和散开加权的成像好一些。 | Shewei Dou Yan Bai Ankit Shandil Degang Ding Dapeng Shi E Mark Haacke Meiyun Wang | 2017 | Asian Journal of Andrology2017，19，4： | 7 |
| 7 | 3D打印技术结合定制锁定加压钢板微创治疗股骨多段粉碎性骨折显示文摘患者,男,34岁,因高处坠落致骨盆骨折、左髋臼双柱骨折(AO分型C1.3型)、左股骨干与髁上粉碎性骨折、左后交叉韧带止点撕脱骨折.入院检查:患者合并失血性休克,双侧气胸,双侧胸腔积液,左侧多发肋骨骨折.早期对患者进行抗休克对症支持治疗,待患者病情稳定后对其行骨折内固定术治疗.急诊行左胫骨结节骨牵引术,外伤2周后行左股骨骨折闭合复位,大型牵张器跨膝关节外固定,骨盆、左髋臼切开复位接骨板内固定术;外伤3周行股骨骨折闭合复位接骨板内固定术. | Ankit Shrivastava 李建宏 戴琎 任广凯 吴丹凯 | 2017 | 临床骨科杂志2017，20，3： | 6 |
| 8 | Chemometrics:A new scenario in herbal drug standardization显示文摘Chromatography and spectroscopy techniques are the most commonly used methods in standardization of herbal medicines but the herbal system is not easy to analyze because of their complexity of chemical composition.Many cutting-edge analytical technologies have been introduced to evaluate the quality of medicinal plants and significant amount of measurement data has been produced.Chemometric techniques provide a good opportunity for mining more useful chemical information from the original data.Then,the application of chemometrics in the field of medicinal plants is spontaneous and necessary.Comprehensive methods and hyphenated techniques associated with chemometrics used for extracting useful information and supplying various methods of data processing are now more and more widely used in medicinal plants,among which chemometrics resolution methods and principal component analysis(PCA)are most commonly used techniques.This review focuses on the recent various important analytical techniques,important chemometrics tools and interpretation of results by PCA.and applications of chemometrics in quality evaluation of medicinal plants in the authenticity,efficacy and consistency. | Ankit Bansal Vikas Chhabra Ravindra K.Rawal Simant Sharma | 2014 | Journal of Pharmaceutical Analysis2014，4，4： | 4 |
| 9 | Multiobjective genetic training and uncertainty quantification of reactive force fields显示文摘The ReaxFF reactive force-field approach has significantly extended the applicability of reactive molecular dynamics simulations to a wide range of material properties and processes.ReaxFF parameters are commonly trained to fit a predefined set of quantummechanical data,but it remains uncertain how accurately the quantities of interest are described when applied to complex chemical reactions.Here,we present a dynamic approach based on multiobjective genetic algorithm for the training of ReaxFF parameters and uncertainty quantification of simulated quantities of interest.ReaxFF parameters are trained by directly fitting reactive molecular dynamics trajectories against quantum molecular dynamics trajectories on the fly,where the Pareto optimal front for the multiple quantities of interest provides an ensemble of ReaxFF models for uncertainty quantification.Our in situ multiobjective genetic algorithm workflow achieves scalability by eliminating the file I/O bottleneck using interprocess communications.The in situ multiobjective genetic algorithm workflow has been applied to high-temperature sulfidation of MoO_(3) by H_(2)S precursor,which is an essential reaction step for chemical vapor deposition synthesis of MoS_(2) layers.Our work suggests a new reactive molecular dynamics simulation approach for far-from-equilibrium chemical processes,which quantitatively reproduces quantum molecular dynamics simulations while providing error bars. | Ankit Mishra Sungwook Hong Pankaj Rajak Chunyang Sheng Ken-ichi Nomura Rajiv K.Kalia Aiichiro Nakano Priya Vashishta | 2018 | npj Computational Materials2018，，1： | 3 |
| 10 | Wear and performance analysis of a 4-stroke diesel engine employing nanolubricants显示文摘 | Ankit Kotia Sheeba Borkakoti Subrata Kumar Ghosh | 2018 | Particuology2018，16，2： | 3 |
| 11 | Insight to drug delivery aspects for colorectal cancer显示文摘Colorectal cancer(CRC) is the third most common cancer diagnosed worldwide in human beings. Surgery, chemotherapy, radiotherapy and targeted therapiesare the conventional four approaches which are currently used for the treatment of CRC. The site specific delivery of chemotherapeutics to their site of action would increase effectiveness with reducing side effects. Targeted oral drug delivery systems based on polysaccharides are being investigated to target and deliver chemotherapeutic and chemopreventive agents directly to colon and rectum. Site-specific drug delivery to colon increases its concentration at the target site, and thus requires a lower dose and hence abridged side effects. Some novel therapies are also briefly discussed in article such as receptor(epidermal growth factor receptor, folate receptor, wheat germ agglutinin, VEGF receptor, hyaluronic acid receptor) based targeting therapy; colon targeted proapoptotic anticancer drug delivery system, gene therapy. Even though good treatment options are available for CRC, the ultimate therapeutic approach is to avert the incidence of CRC. It was also found that CRCs could be prevented by diet and nutrition such as calcium, vitamin D, curcumin, quercetin and fish oil supplements. Immunotherapy and vaccination are used nowadays which are showing better results against CRC. | Arvind Gulbake Aviral Jain Ashish Jain Ankit Jain Sanjay K Jain | 2016 | World Journal of Gastroenterology2016，22，2： | 3 |
| 12 | Effect of Biogas Digested Liquid on CH_4 and N_2O Flux in Paddy Ecosystem显示文摘Biogas production generates digested slurry as a byproduct. It can be used as a fertilizer especially after its conversion into digested liquid. A pot based study was conducted in order to evaluate the effect of the application of digested liquid on CH 4 and N 2 O flux, and plant biomass in paddy. Analysis revealed that digested liquid treated soils released more CH 4 compared to ammonium sulphate and the control. Ammonium sulphate treated soil emitted the highest N 2 O whereas digested liquid application decreased its emission significantly. Further, the cumulative emission over 101 d of the experiment was found to be higher for CH 4(16.9 to 29.9 g m-2) compared to N 2 O(-49.3 to 18.9 mg m-2) for all treatments. Digested liquid application had positive impact on plant variables such as panicle number and weight of panicles. This study suggests that digested liquid application significantly decrease N 2 O emission and increase CH 4 emission possibly due to affecting the availability of organic C in the soil to microbial activity for methanogenesis. Another possibility for enhancing CH 4 emission by following biogas digested liquid could be attributed to the increase in plant biomass. | Ankit Singla Kazuyuki Inubushi | 2014 | Journal of Integrative Agriculture2014，13，3： | 3 |
| 13 | 马蹄花叶提取物在雄性白化病小鼠体内的抗炎作用(英文)显示文摘AIM:To study the in vivo anti-inflammatory activity of Tabernaemontana divaricata leaf extract on male albino mice.METHODS:Aqueous decoction and methanol leaf extracts were tested for their ability to reduce croton oil-induced edema in the mouse ear after topical application.The methanol leaf extract dose-dependently inhibited the croton oil-induced ear edema in mice(ID50<500μg·cm 2).A bioassay-guided liquid–liquid fractionation of this methanol extract gave four active fractions:water insoluble(F1),hexane(F2),ethyl acetate(F3)and water(F4).RESULTS:The hexane fraction showed a very high activity(42.1%inhibition at0.7μg·cm 2)as compared to the control.The other fractions were less active(F1:56.1%at 506.2μg·cm-2;F3:57.3%at 289.3μg·cm 2;and F4:31.9%for 203.8μg·cm 2)while indomethacin gave 48.8%of inhibition at 90μg·cm 2.The activity of F1 and F3 may be at least in part explained by the presence of anti-inflammatory flavonoids,while the activity was not correlated to the tannin contents.No compounds were detected in the most active F2 fraction.CONCLUSIONS:The results give a rational support to the traditional use of T.divaricata in tropical India as anti-inflammatory agent. | Sachin Jain Praveen Sharma Santosh Ghule Ankit Jain Nitesh Jain | 2013 | 中国天然药物2013，11，5： | 2 |
| 14 | 基于微生物诱导碳酸钙沉淀技术加固滨海软土的试验研究显示文摘为有效利用微生物诱导碳酸钙沉淀(MICP)技术加固滨海软土,以养护时间、营养液浓度、菌液浓度为影响因素,以抗剪强度、含水率和干密度为指标,进行MICP技术加固软土性能的实验研究.结果表明:MICP技术适用于处理滨海软土,可以显著提升软土的物理性质、提高软土强度.仅作用三天,可提高抗剪强度超过两倍,合理的养护天数、营养液浓度、菌液浓度等组合因素对加固性能也有直接影响.相关机理性的研究结果为滨海软土地基处理提供了一个全新的技术手段. | 蚁曼冰 王延宁 刘东 Ankit Garg 林鹏 | 2020 | 汕头大学学报(自然科学版)2020，35，3： | 2 |
| 15 | QualiW of life following total hip arthroplasW in patients with acetabular fractures, previously managed by open reduction and internal fixation显示文摘 | Prasoon Kumar Ramesh Kumar Sen Vishal Kumar Ankit Dadra | 2016 | Chinese Journal of Traumatology2016，19，4： | 2 |
| 16 | Impact of high pressure processing on total antioxidant activity, phenolic, ascorbic acid, anthocyanin content and colour of strawberry and blackberry purées显示文摘 | Ankit Patras Nigel P. Brunton Sara Da Pieve Francis Butler | 2008 | Innovative Food Science and Emerging Technologies2008，，3： | 2 |
| 17 | Topological Studies of Three-dimensional Flows in a High Pressure Compressor Stator Blade Row without and with Boundary Layer Aspiration显示文摘This paper presents a numerical study of the flow topologies of three-dimensional (3D) flows in a high pressure compressor stator blade row without and with boundary layer aspiration on the hub wall. The stator blade is representative of the first stage operating under transonic inlet conditions and the blade design encourages development of highly complex 3D flows. The blade has a small tip clearance. The computational fluid dynamics (CFD) studies show progressive increase of hub corner stall with the increase in incidence. Aspiration is implemented on the hub wall via a slot in the corner between the hub wall and the suction surface. The CFD studies show aspiration to be sensitive to the suction flow rate; lower rate leads to very complex flow structures and increased level of losses whereas higher rate renders aspiration effective for control of hub corner separation. The flow topologies are studied by trace of skin friction lines on the walls. The nature of flow can be explained by the topological rules of closed separation. Furthermore, a deeper analysis is done for a particular case with advanced criterion to test the non-degeneracy of critical points in the flow field. | Ankit SACHDEVA Francis LEBOEUF | 2011 | Chinese Journal of Aeronautics2011，24，5： | 2 |
| 18 | Editorial for Internet of Things (IoT) and Artificial Intelligence (AI) in geotechnical engineering显示文摘We are privileged to be invited by the Honorary Editor-in-Chief,Professor Qihu Qian,Editor-in-Chief,Professor Xia-Ting Feng,and the editorial staff of the Journal of Rock Mechanics and Geotechnical Engineering(JRMGE),to serve as Guest Editors for this Special Issue(SI).Over the last decade,the application of the Internet of Things(IoT)and Artificial Intelligence(AI)has increased rapidly to enhance automation in various industries.For efficient construction and maintenance of geotechnical infrastructures(slopes,tunnels,pipelines,and other ground infrastructures),there is a need to access and examine measured data in real-time.Variations in data type due to the usage of unmanned aerial vehicle(UAV)photogrammetric sensors,LiDAR,and fiber optic sensing techniques make data management and analysis more complicated.Advanced artificial intelligence,metaheuristic optimization,and data science can be reliable methods in geotechnical engineering for site investigation,risk assessment,design,construction,and maintenance at a higher level. | Honghu Zhu Ankit Garg Xiong(Bill)Yu Hannah Wanhuan Zhou | 2022 | Journal of Rock Mechanics and Geotechnical Engineering2022，14，4： | 2 |
| 19 | Outcomes of kidney transplantation in patients with hepatitis B virus infection:A systematic review and meta-analysis显示文摘AIM To assess outcomes of kidney transplantation including patient and allograft outcomes in recipients with hepatitis B virus(HBV) infection, and the trends of patient's outcomes overtime.METHODS A literature search was conducted using MEDLINE, EMBASE and Cochrane Database from inception through October 2017. Studies that reported odds ratios(OR) of mortality or renal allograft failure after kidney transplantation in patients with HBV [defined as hepatitis B surface antigen(HBs Ag) positive] were included. The comparison group consisted of HBs Agnegative kidney transplant recipients. Effect estimates from the individual study were extracted and combined using random-effect, generic inverse variance method of Der Simonian and Laird. The protocol for this metaanalysis is registered with PROSPERO(International Prospective Register of Systematic Reviews; no. CRD42017080657).RESULTS Ten observational studies with a total of 87623 kidney transplant patients were enrolled. Compared to HBs Ag-negative recipients, HBs Ag-positive status was significantly associated with increased risk of mortality after kidney transplantation(pooled OR = 2.48; 95%CI: 1.61-3.83). Meta-regression showed significant negative correlations between mortality risk after kidney transplantation in HBs Ag-positive recipients and year of study(slopes =-0.062, P = 0.001). HBs Agpositive status was also associated with increased risk of renal allograft failure with pooled OR of 1.46(95%CI: 1.08-1.96). There was also a significant negative correlation between year of study and risk of allograft failure(slopes =-0.018, P = 0.002). These associations existed in overall analysis as well as in limited cohort of hepatitis C virus-negative patients. We found no publication bias as assessed by the funnel plots and Egger's regression asymmetry test with P = 0.18 and 0.13 for the risks of mortality and allograft failure after kidney transplantation in HBs Ag-positive recipients, respectively.CONCLUSION Among kidney transplant patients, there are significant associations between HBs Ag-positive status and poor outcomes including mortality and allograft failure. However, there are potential improvements in patient and graft survivals in HBs Ag-positive recipients overtime. | Charat Thongprayoon Wisit Kaewput Konika Sharma Karn Wijarnpreecha Napat Leeaphorn Patompong Ungprasert Ankit Sakhuja Franco H Cabeza Rivera Wisit Cheungpasitporn | 2018 | World Journal of Hepatology2018，10，2： | 2 |
| 20 | Antifertility effect of chronically administered Tabernaemontana divaricata leaf extract on male rats显示文摘Objective:To investigate the antifertility effect of chronically administered Tabernaemontana divarkala(T.divaricata) leaf extract on male rats.Methods:The effect of 50%ethanol extract of T.divaricata leaves on reproduction was studied on male rats.The study was divided into four groups of five animals each.The first groups(1) received vehicle alone to serve as control. The second,third and fourth groups(Ⅱ,ⅡandⅣ) of animals were administered the leaf extract daily at 50 mg/kg body weight,p.o.,100 nig/kg body weight,p.o.,and 200 mg/kg body weight, p.o.,respectively,for a period of 60 days.Results:Significant decreases in the weight of testes, epididymis,seminal vesicle and ventral prostate were observed.A dose related reduction in the testicular sperm count,epididymal sperm count and motility,number of fertile male,ratio between delivered and inseminated females and numbers of pups were observed.The testis showed a clear correlation between the dose and severity of lesions of seminiferous epithelium. In general,the seminiferous tubules appear reduced in size with a frequently filled eosinophilic material.Spermatogenesis arrested at the secondary spermatocyte stage.Pachytene spermatocytes were undergoing degeneration.Disorganisation and sloughing of immature germ cell were visible. Leydinf cells were atrophied.No morphological changes were observed in Sertoli cells.Significant reduction in serum concentration of luteinizing hormone and testosterone were observed.No distinct change in serum FSH concentration was recorded.The final body weights of all groups were elevated markedly.No alterations were recorded in any hematologiocal parameters. Conclusions:It is concluded that the 50%ethanol extract of T.divaricata leaf produced dose related effect on male reproduction without altering general bodv metabolism. | Sachin Jain Ankit Jain Pritesh Paliwal Shailendra Singh Solanki | 2012 | Asian Pacific Journal of Tropical Medicine2012，5，7： | 1 |
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