as [ASAP] Balancing Density Functional Theory Interaction Energies in Charged Dimers Precursors to Organic Semiconductors By feedproxy.google.com Published On :: Tue, 05 May 2020 04:00:00 GMT Journal of Chemical Theory and ComputationDOI: 10.1021/acs.jctc.9b01193 Full Article
as [ASAP] Markov State Model Analysis of Haloperidol Binding to the D<sub>3</sub> Dopamine Receptor By feedproxy.google.com Published On :: Wed, 06 May 2020 04:00:00 GMT Journal of Chemical Theory and ComputationDOI: 10.1021/acs.jctc.0c00013 Full Article
as [ASAP] Binding Dynamics of siRNA with Selected Lipopeptides: A Computer-Aided Study of the Effect of Lipopeptides’ Functional Groups and Stereoisomerism By feedproxy.google.com Published On :: Wed, 06 May 2020 04:00:00 GMT Journal of Chemical Theory and ComputationDOI: 10.1021/acs.jctc.9b01261 Full Article
as [ASAP] Predicting Reactive Cysteines with Implicit-Solvent-Based Continuous Constant pH Molecular Dynamics in Amber By feedproxy.google.com Published On :: Wed, 06 May 2020 04:00:00 GMT Journal of Chemical Theory and ComputationDOI: 10.1021/acs.jctc.0c00258 Full Article
as [ASAP] Comprehensive Evaluation of Fourteen Docking Programs on Protein–Peptide Complexes By feedproxy.google.com Published On :: Wed, 06 May 2020 04:00:00 GMT Journal of Chemical Theory and ComputationDOI: 10.1021/acs.jctc.9b01208 Full Article
as [ASAP] OPUS-Fold: An Open-Source Protein Folding Framework Based on Torsion-Angle Sampling By feedproxy.google.com Published On :: Wed, 06 May 2020 04:00:00 GMT Journal of Chemical Theory and ComputationDOI: 10.1021/acs.jctc.0c00186 Full Article
as [ASAP] Generalized Moment Correction for Long-Ranged Electrostatics By feedproxy.google.com Published On :: Thu, 07 May 2020 04:00:00 GMT Journal of Chemical Theory and ComputationDOI: 10.1021/acs.jctc.9b01003 Full Article
as [ASAP] A Two-Ended Data-Driven Accelerated Sampling Method for Exploring the Transition Pathways between Two Known States of Protein By feedproxy.google.com Published On :: Fri, 08 May 2020 04:00:00 GMT Journal of Chemical Theory and ComputationDOI: 10.1021/acs.jctc.9b01184 Full Article
as [ASAP] Electronic Structure of Multicomponent Organic Molecular Materials: Evaluation of Range-Separated Hybrid Functionals By feedproxy.google.com Published On :: Fri, 08 May 2020 04:00:00 GMT Journal of Chemical Theory and ComputationDOI: 10.1021/acs.jctc.0c00138 Full Article
as [ASAP] Charge Interactions Modulate the Encounter Complex Ensemble of Two Differently Charged Disordered Protein Partners of KIX By feedproxy.google.com Published On :: Fri, 08 May 2020 04:00:00 GMT Journal of Chemical Theory and ComputationDOI: 10.1021/acs.jctc.9b01264 Full Article
as [ASAP] Artificial Neural Networks Applied as Molecular Wave Function Solvers By feedproxy.google.com Published On :: Fri, 08 May 2020 04:00:00 GMT Journal of Chemical Theory and ComputationDOI: 10.1021/acs.jctc.9b01132 Full Article
as [ASAP] Generalized Form for Finite-Size Corrections in Mutual Diffusion Coefficients of Multicomponent Mixtures Obtained from Equilibrium Molecular Dynamics Simulation By feedproxy.google.com Published On :: Fri, 08 May 2020 04:00:00 GMT Journal of Chemical Theory and ComputationDOI: 10.1021/acs.jctc.0c00268 Full Article
as [ASAP] Spin–Orbit Matrix Elements for a Combined Spin-Flip and IP/EA approach By feedproxy.google.com Published On :: Fri, 08 May 2020 04:00:00 GMT Journal of Chemical Theory and ComputationDOI: 10.1021/acs.jctc.0c00103 Full Article
as Vizag gas leak: Situation 'normal' says AP govt By timesofindia.indiatimes.com Published On :: Sat, 09 May 2020 11:26:37 GMT The Andhra Pradesh government on Saturday said the situation was "normal" in RR Venkatapuram village, where a styrene vapour leak from the LG Polymers plant claimed 12 lives and left over 300 people hospitalized with various ailments. Full Article
as ‘Shouted at them to wake up, train was louder’ By timesofindia.indiatimes.com Published On :: Sat, 09 May 2020 08:39:09 GMT Survivors recount the horror of the accident on the railway tracks that left 16 migrant workers dead near Aurangabad Full Article
as Teachers to check class 10, 12 test papers at home By timesofindia.indiatimes.com Published On :: Sat, 09 May 2020 12:36:04 GMT The evaluation for class 10, 12 board exams will be done by teachers at their homes and 3,000 schools have been identified as exam centres to deliver the answer sheets to them, Union HRD minister Ramesh Pokhriyal 'Nishank' said on Saturday. He said 1.5 crore answer sheets of already conducted class 10, 12 exams will be delivered to teachers. Full Article
as Coronavirus: TN relaxes lockdown measures further By timesofindia.indiatimes.com Published On :: Sat, 09 May 2020 11:15:55 GMT The Tamil Nadu government on Saturday relaxed certain lockdown measures in non-containment areas across the state, including permission to do takeaway services at teashops. This will come into effect on May 11. All private establishments can function with 33% strength between 10.30am and 6pm in Greater Chennai Police limits and 10am and 7pm in the rest of the state. Full Article
as I am healthy, not suffering from any disease: Shah By timesofindia.indiatimes.com Published On :: Sat, 09 May 2020 12:07:45 GMT Union home minister Amit Shah on Saturday said he is "totally healthy" and not suffering from any disease. Shah said rumours about his health conditions have been spread through social media. "I am totally healthy and I am not suffering from any disease," he said in the statement in Hindi which was posted on his Twitter handle. Full Article
as The high-accuracy prediction of carbon content in semi-coke by laser-induced breakdown spectroscopy By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Advance ArticleDOI: 10.1039/C9JA00443B, PaperXiangjun Xu, Angze Li, Xianshuang Wang, Chunjie Ding, Suling Qiu, Yage He, Tianqi Lu, Feng He, Bingsuo Zou, Ruibin LiuLIBS technology is used in the realization process of semi-coke detection.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
as How much aqueous sample can an inductively coupled plasma withstand? By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Accepted ManuscriptDOI: 10.1039/D0JA00070A, Technical NoteAhmed Al Hejami, John A. Burgener, Mirah Burgener, Diane BeaucheminDuring this study, a compact infrared-heated sample introduction system at 200°C, consisting of a modified cyclonic spray chamber with a ceramic rod heater within a baffle in its centre and...The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
as Atomic fluorescence spectrometry for ultrasensitive determination of bismuth based on hydride generation – the role of excitation source, interference filter and flame atomizers By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Advance ArticleDOI: 10.1039/D0JA00043D, PaperBarbora Štádlerová, Marta Kolrosová, Jiří Dědina, Stanislav MusilA method of highly sensitive bismuth determination by hydride generation coupled with in-house assembled non-dispersive atomic fluorescence spectrometry was developed.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
as Diagnostics of laser induced plasmas at late delay times By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Advance ArticleDOI: 10.1039/C9JA00439D, PaperL. J. Martino, C. A. D'AngeloImplementation of the plasma diagnostic method to estimate the evolution of temperature and electronic density at advanced postbreakdown times.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
as ‘Blind time’ – current limitations on laser ablation multi-collector inductively coupled plasma mass spectrometry (LA-MC-ICP-MS) for ultra-transient signal isotope ratio analysis and application to individual sub-micron sized uranium particles By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Advance ArticleDOI: 10.1039/D0JA00066C, PaperGrant Craig, Matthew S. A. Horstwood, Helen J. Reid, Barry L. SharpGaps in acquisition between integration times for MC-ICP-MS can introduce isotope ratio bias with a mixed detector array.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
as Iso-Compass: new freeware software for isotopic data reduction of LA-MC-ICP-MS By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Advance ArticleDOI: 10.1039/D0JA00084A, Technical NoteWen Zhang, Zhaochu Hu, Yongsheng LiuNew freeware, Iso-Compass, is developed specifically to process the isotope data from LA-MC-ICP-MS and MC-ICP-MS.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
as Inductively coupled plasma mass spectrometry coupled to cation exchange chromatography for the determination of trace nickel in alkaline electrolyte By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Advance ArticleDOI: 10.1039/D0JA00071J, Technical NoteLukas Miner, Diane BeaucheminCone corrosion by alkaline solutions with flow injection is prevented using cation-exchange chromatography coupled to inductively coupled plasma mass spectrometry.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
as Development of a method for the direct determination of fluorine in solid samples using electrothermal vaporization coupled to inductively coupled plasma optical emission spectrometry By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Advance ArticleDOI: 10.1039/D0JA00079E, Technical NotePatricia Maung, Diane BeaucheminETV-ICPOES in atomic emission mode allows the direct determination of as low as 30 μg kg−1 fluorine in solid samples.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
as Laser-induced breakdown spectroscopy (LIBS) spectra interpretation and characterization using parallel factor analysis (PARAFAC): a new procedure for data and spectral interference processing fostering the waste electrical and electronic equipment (WEEE) By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Advance ArticleDOI: 10.1039/D0JA00026D, PaperJeyne Pricylla Castro, Edenir Rodrigues Pereira-Filho, Rasmus BroFor the first time, PARAFAC was used to interpret and characterize LIBS spectra, providing the pure spectra, the signal profile and relative concentration of base and noble elements present on a printed circuit board from the hard disk.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
as Portable Photochemical Vapor Generation-Microwave Plasma Optical Emission Spectrometer By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Accepted ManuscriptDOI: 10.1039/D0JA00104J, Technical NoteYujia Deng, Wen Zeng, Xiaoming Jiang, Xiandeng HouA low power microwave plasma torch as an excitation source was combined with photochemical vapor generation (PVG) and a miniaturized charge-coupled device to construct a portable optical emission spectrometer. The...The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
as Calibration-free quantitative analysis of D/H isotopes with fs-laser filament By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Accepted ManuscriptDOI: 10.1039/D0JA00062K, PaperGenggeng Li, Huaming Hou, Pengxu Ran, Yunlong Zhao, Zhengye ZhongThe analytical characteristics of D/H isotopes with fs-laser filament are investigated via analyzing a set of D-enriched water samples with D concentrations from 0.5 to 20%. The filament emission spectra...The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
as Secondary Ion Mass Spectrometry for Biological Applications By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Advance ArticleDOI: 10.1039/D0JA90020F, EditorialDirk SchaumlöffelDirk Schaumlöffel introduces the JAAS themed collection on Secondary Ion Mass Spectrometry for Biological Applications.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
as High performance method for the accurate and precise determination of silicon isotopic compositions in bulk silicate rock samples using laser ablation MC-ICP-MS By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Accepted ManuscriptDOI: 10.1039/D0JA00036A, PaperChenxi Zhang, He Zhao, Wen Zhang, Tao Luo, Ming Li, Keqing Zong, Yongsheng Liu, Zhaochu HuMC-ICP-MS has become one of the most powerful analytical methods for Si isotopes in bulk liquid and solid samples in the past decade. Laser ablation provides direct sampling of solid...The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
as A total consumption (up to 75 μL min−1) infrared-heated sample introduction system for inductively coupled plasma optical emission spectrometry By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Advance ArticleDOI: 10.1039/D0JA00068J, PaperAhmed Al Hejami, Mirah J. Burgener, John Burgener, Diane BeaucheminA compact infrared-heated sample introduction system provides similar analytical performance with higher robustness and faster washout than commercially available nebulization systems.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
as Feasibility study on application of Laser Induced Breakdown Spectroscopy for detection & identification of failed fuel pin and sodium-water reaction in Fast Reactors By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Accepted ManuscriptDOI: 10.1039/D0JA00077A, PaperNamitha J., Ujjwal Kumar Maity, Thangaraj Selvalakshmi, Manoravi Periasamy, Ashok Kumar G. V. S., Joseph M, Nagarajan SivaramanIn a fast reactor, during the analysis of core cover gas, the presence of gaseous fission products, namely, Kr and Xe or presence of He (in case of He bonded...The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
as Extractive separation of rare earth elements and their determination by inductively coupled plasma optical emission spectrometry in geological samples By feeds.rsc.org Published On :: J. Anal. At. Spectrom., 2020, Accepted ManuscriptDOI: 10.1039/D0JA00190B, PaperSusanta Kumar Pradhan, Balram AmbadeA simple, rapid and effective solvent extraction separation of rare earth elements (REEs) has been developed for their determination in geological samples such as rock, soil and core samples by...The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
as Top 3 Bible Studies on Gray Areas of Faith for Fall 2019 By feeds.christianitytoday.com Published On :: Mon, 02 Sep 2019 03:00:00 PDT This fall’s top three list cover bible studies on gray areas of faith. Each curriculum gives you resources to lead a group study, but is also perfect as your own personal study. Full Article
as Top 5 Bible Courses for Christmas By feeds.christianitytoday.com Published On :: Fri, 29 Nov 2019 23:00:00 PST These were your favorite studies on this topic. Full Article
as What kind of balance should we strike between the Easter bunny and the empty grave? By feeds.christianitytoday.com Published On :: Mon, 20 Jan 2020 16:13:00 PST Full Article
as Stop Doing These 7 Embarrassing Things on Social Media By www.rss-specifications.com Published On :: Thu, 1 Aug 2019 14:17:08 -0400 When you think about embarrassing social media behavior, you probably think about octogenarians who accidentally post their phone numbers in a Facebook status. But embarrassing social media perils are everywhere for users of all ages, particularly for actors. But it is 2019 and social media is as important to your acting brand as your signature monologue or audition song, so we want to help you avoid these digital landmines and lead with your best online foot forward. complete article Full Article
as How Social Media Debases Discourse By www.rss-specifications.com Published On :: Wed, 14 Aug 2019 14:24:01 -0400 Smith had a Twitter meltdown this morning in response to some relatively gentle and polite criticism from me. Smith is a perfectly respectable journalist in his day job — a purveyor of tediously predictable received opinion, to be sure, but there is room for all kinds. Online, he is transformed through the emotional alchemy of Twitter into a deranged, masturbatory, feces-flinging rage monkey straight from Hell’s own zoo. He is, amusingly enough, so enraged that he cannot even get straight what he himself has written. I hope readers will forgive the brief point-by-point here. I promise it adds up to something. complete article Full Article
as Glassdoor Finds That Twitter Is the Top-Paying Social Network in 2019 By www.rss-specifications.com Published On :: Thu, 26 Sep 2019 17:56:40 -0400 Twitter topped its social network competition on job and recruiting site Glassdoor’s list of the 25 highest paying companies in 2019, coming in at No. 3 overall with a median base salary of $162,852. Other social networks to crack the top 25 were LinkedIn (No. 7, $157,402) and Facebook (No. 8, $152,962). The list was dominated by tech firms, many of which are based in Silicon Valley. complete article Full Article
as What is social medias role in combating the spread of misinformation? By www.rss-specifications.com Published On :: Mon, 21 Oct 2019 09:10:25 -0400 How have the rise of social media and spread of misinformation changed the news media landscape? As a major election year nears and the public questions the role of Facebook in combating misinformation, Andrew Pergam, director of governance and strategic initiatives at Facebook, gave a glimpse of what is happening behind the scenes at the social media company during a symposium at the University of Utah on Friday. Misinformation is one of the companys most pressing and scrutinized issues, he said. We are under an immense amount of pressure to do more to tackle viral information more quickly. complete article Full Article
as An Easy Guide to Creating Social Media Videos that Drive Results By www.rss-specifications.com Published On :: Mon, 28 Oct 2019 09:17:45 -0400 When was the last time you watched a video on Facebook? What about Instagram or Twitter? My guess is that it was probably within the last day. The reason for this guess is because video continues to be one of the most powerful forms of content on social media. You can not take a digital step without coming face-to-face with a video – and there is a reason for this. complete article Full Article
as Why You Need an RSS Feed for Your Podcast (+How to Make One) By www.rss-specifications.com Published On :: Wed, 20 Nov 2019 09:46:24 -0400 The method of getting your podcast out to the world might not be the way you think. Unlike most popular forms of online content, podcasts utilize a form of forbidden arcane knowledge; an ancient method of internet distribution discussed in hushed tones and under furtive glances as really simple syndication or RSS for short. Learning how to make your own podcast-only RSS feed is a crucial element for any successful show. complete article Full Article
as Why You Need an RSS Feed for Your Podcast (+How to Make One) By www.rss-specifications.com Published On :: Mon, 2 Mar 2020 12:40:09 -0500 The method of getting your podcast out to the world might not be the way you think. Unlike most popular forms of online content, podcasts utilize a form of forbidden arcane knowledge; an ancient method of internet distribution discussed in hushed tones and under furtive glances as really simple syndication or RSS for short. Learning how to make your own podcast-only RSS feed is a crucial element for any successful show. Feel free to jump to a section of your choosing if you’re looking for something in particular: What is a podcast-only RSS feed? Why you need a podcast-only RSS feed How to craft a podcast-only RSS feed How to switch to a podcast-only RSS feed complete article Full Article
as The 2020 Ranking Of Free-Market Think Tanks Measured By Social Media Impact By www.rss-specifications.com Published On :: Fri, 8 May 2020 17:00:13 -0400 Due to the coronavirus pandemic think tanks around the world are working under quarantine and have cancelled all events in the coming months. They will have to rely more on social media to get their messages across. How successful are free-market think tanks today in trying to attract traffic to their websites, as well as views and followers on other platforms? complete article Full Article
as Why You Need an RSS Feed for Your Podcast By www.rss-specifications.com Published On :: Fri, 5 Jun 2020 06:35:31 -0400 The method of getting your podcast out to the world might not be the way you think. Unlike most popular forms of online content, podcasts utilize a form of forbidden arcane knowledge; an ancient method of internet distribution discussed in hushed tones and under furtive glances as really simple syndication or RSS for short. First of all, we need to draw a critical distinction between traditional RSS feeds and podcast-only RSS feeds. An RSS feed is a format of internet file that can contain any sort of content, while the podcast-only variety is, unsurprisingly restricted to only podcasts. A podcast-only RSS feed is a subtype of the internet file type known as RSS. This file can be easily distributed to a variety of different directories that updates the displayed content in real time alongside changes made by the creator. This format restriction is what allows podcast directories to so easily display and showcase new content; everything that is submitted is, from a technical standpoint, completely identical! Full Article
as 43 Covid-19 cases on Saturday, active count below 1000 in Andhra Pradesh By timesofindia.indiatimes.com Published On :: Sat, 09 May 2020 15:34:17 IST Full Article
as Four new cases of Covid-19 reported in Uttarakhand today By timesofindia.indiatimes.com Published On :: Sat, 09 May 2020 15:54:19 IST Full Article
as Private mobile phones restored in Kashmir; situation remains calm By timesofindia.indiatimes.com Published On :: Sat, 09 May 2020 15:58:16 IST Full Article
as I am healthy, not suffering from any disease, says Amit Shah By timesofindia.indiatimes.com Published On :: Sat, 09 May 2020 17:37:45 IST Union home minister Amit Shah on Saturday said he is "totally healthy" and not suffering from any disease. Shah said rumours about his health conditions have been spread through social media. "I am totally healthy and I am not suffering from any disease," he said in the statement in Hindi which was posted on his Twitter handle. Full Article