liz Whisper This, But Java Deserialization Vulnerability Affects More Libraries By packetstormsecurity.com Published On :: Mon, 07 Dec 2015 15:03:13 GMT Full Article headline flaw oracle java
liz Cisco Security Kit Has Java Deserialization Bug And A Default Password Snafu By packetstormsecurity.com Published On :: Thu, 08 Mar 2018 14:03:24 GMT Full Article headline flaw password cisco java
liz Microsoft Server Service NetpwPathCanonicalize Overflow By packetstormsecurity.com Published On :: Thu, 26 Nov 2009 00:34:53 GMT This Metasploit module exploits a stack overflow in the NetApi32 CanonicalizePathName() function using the NetpwPathCanonicalize RPC call in the Server Service. It is likely that other RPC calls could be used to exploit this service. This exploit will result in a denial of service on on Windows XP SP2 or Windows 2003 SP1. A failed exploit attempt will likely result in a complete reboot on Windows 2000 and the termination of all SMB-related services on Windows XP. The default target for this exploit should succeed on Windows NT 4.0, Windows 2000 SP0-SP4+, Windows XP SP0-SP1 and Windows 2003 SP0. Full Article
liz Demand Response: A Valuable Tool that Can Help California Realize its Clean Energy Potential By feedproxy.google.com Published On :: 2015-01-28T12:54:00Z A tool only has value if it’s used. For example, you could be the sort of person who’s set a goal of wanting to exercise more. If someone gives you a nifty little Fitbit to help you do that, and you never open the box, how useful, then, is this little device? The same is true about smart energy management solutions: good tools exist, but whether it’s calories or energy use that you want to cut, at some point those helpful devices need to be unpacked. Full Article Energy Efficiency Hydropower Baseload Storage Energy Efficiency Bioenergy Policy Wind Power Opinion & Commentary Solar Geothermal
liz Renewable Energy Responsible for First Ever Carbon Emissions Stabilization By feedproxy.google.com Published On :: 2015-06-17T23:00:00Z Carbon emissions in 2014 remained at the previous year’s levels of 32.3 billion metric tons — a milestone that points to the impact worldwide renewable energy investment is having in the face of a 1.5 percent annual increase in global energy consumption, according to a new report from REN21. The tenth annual Renewables 2015 Global Status Report cites “increased penetration of renewable energy” and improvements in energy efficiency as the chief reasons for the noted emissions stabilization. Full Article Energy Efficiency News Hydropower Baseload Storage Energy Efficiency Bioenergy Policy Wind Power Solar Geothermal
liz Papua New Guinea First to Finalize Climate Plan Under Paris Agreement By feedproxy.google.com Published On :: 2016-04-08T16:48:00Z Papua New Guinea recently became the first country to formally submit the final version of its national climate action plan (called a “Nationally Determined Contribution,” or NDC) under the Paris Agreement. The small Pacific nation’s plan to transition to 100 percent renewable energy by 2030 is no longer just an “intended” nationally determined contribution (INDC) — it is now the country’s official climate plan. Full Article Hydropower Baseload Bioenergy Wind Power Solar Geothermal
liz Lebanese Shi'ite leader may urge decriminalization of homosexuality By www.jpost.com Published On :: Sat, 09 May 2020 17:50:07 GMT Acting US director of national intelligence Richard Grenell says he spoke "with an influential Lebanese Shi'ite leader" who is "close" to coming out publicly in favor of decriminalizing homosexuality Full Article Iran Lebanon LGBT
liz Aha™ Drives Ahead with Hundreds More Stations of Personalized Location-Based Content for Drivers By news.harman.com Published On :: Mon, 07 Jan 2013 05:00:00 GMT LAS VEGAS – Aha by HARMAN™ continues to bring drivers the widest array of options to be entertained and informed safely on the road. Today Aha announced partnerships with four of the web's leading location-based service providers that will bring hundreds of new personalized stations of location-based services to drivers who use Aha. By the end of 2013, Aha will be installed into vehicles by more than 10 auto manufacturers which in total represent more than 50 percent of all cars sold in the USA/Canada and up to 30 percent in Europe. Aha brings a world of infotainment to drivers including both mainstream and niche content. Because Aha is fully customizable, users can create the radio experience they want, and take it anywhere. Full Article
liz The challenges of India's industrialization By feeds.reuters.com Published On :: Mon, 21 Nov 2011 17:22:41 -0500 Professor Ashutosh Varshney of Brown University analyzes the current state of India's democratic system as well as the strengths and challenges in this rapidly growing nation. Full interview. Full Article
liz How Data-driven Personalized Learning is Propelling the Learning Industry Forward By feedproxy.google.com Published On :: Sun, 10 May 2020 05:26:03 +0000 - 5 MIN READ - The post How Data-driven Personalized Learning is Propelling the Learning Industry Forward appeared first on e-Learning Feeds. Full Article Educational Technology LMS analytics LMS trends
liz When worlds collide: Shane Warne opens up on Liz Hurley ‘circus’ By www.foxsports.com.au Published On :: 2020-05-09T02:20:00.000+00:00 Watch A Week With Warnie, part of a week-long pop-up channel on Foxtel and Foxtel Now, from Monday 8pm (EST)! Full Article
liz Janet Jackson Hospitalized Ahead of Canadian Gig By www.medindia.net Published On :: Singer Janet Jackson has been admitted to hospital after she fell ill hours before her scheduled concert in Montreal, Canada. The 42-year-old singer got Full Article
liz Clear Backpacks: For a Personalized Style Statement By feedproxy.google.com Published On :: Bags play an important role in our everyday life. Have a look around and you will see everyone with a bag of their own. Be it a student, a working women, a businessman, for that matter anyone, bags are inseparable. In... Full Article
liz Identify and mobilize migrants' skills for development By www.oecd.org Published On :: Fri, 05 Oct 2012 09:30:00 GMT The purpose of this joint OECD/AFD initiative is to propose ways of thinking about new public policies that could better harness the skills of diasporas to foster development in the countries of origin. Full Article
liz Winner of the OECD Education Data Visualization Challenge By oecdeducationtoday.blogspot.fr Published On :: Wed, 09 Jan 2013 12:39:00 GMT This interactive chart, designed by Krisztina Szucs and Mate Cziner from Hungary, condenses highly complex data on the costs and benefits of education around the world. It clearly highlights important facts showing students, parents and policy makers where the real costs and benefits lie for them in relation to education Full Article
liz Equalities Minister Liz Truss lambasts trans advocates for claiming they had Government approval By www.dailymail.co.uk Published On :: Sat, 09 May 2020 21:06:53 GMT Equalities Minister Liz Truss ordered EqualiTeach to stop using the logo of the Government Equalities Office on its controversial guidelines stating teachers must allow trans pupils to use toilets of their choice. Full Article
liz Ruthie Ann Miles announces that she has given birth to daughter Hope Elizabeth By www.dailymail.co.uk Published On :: Sun, 10 May 2020 06:52:51 GMT Broadway star Ruthie Ann Miles, 37, has given birth to a baby girl and announced it on her Instagram. Hope Elizabeth was born last month to her and husband Jonathan Blumenstein. Full Article
liz BRITs 2020: Lizzo shows off her curves in a tan leather bodysuit as she storms the stage By www.dailymail.co.uk Published On :: Wed, 19 Feb 2020 00:29:43 GMT Lizzo pulled out all the stops as she took to the stage for the Brit Awards at the O2 Arena on Tuesday night. Full Article
liz BRITs 2020: Lizzo is a sight to behold in Hershey's chocolate bar dress By www.dailymail.co.uk Published On :: Wed, 19 Feb 2020 01:12:56 GMT The singer, 31, ensured all eyes were on her as she arrived on the red carpet at the BRIT Awards at The 02 Arena in London on Thursday. Full Article
liz Lizzo parties at The Box until 4am after downing tequila at the BRIT Awards 2020 By www.dailymail.co.uk Published On :: Sun, 23 Feb 2020 15:28:18 GMT Lizzo, 31, looked sensational in a sheer dress over a racy corset for her afterparty look, emerging from The Box after a night of party hopping. Full Article
liz Classic Ferrari 250 GTE used by the Polizia in Rome in the 1960s is up for sale By www.dailymail.co.uk Published On :: Wed, 22 Apr 2020 08:17:07 GMT The Ferrari 250 spend six years in service chasing criminals through the streets of Rome, making it the most stylish paddy wagon to have patrolled roads. Full Article
liz New coronavirus hospitalizations down to lowest number since the lockdown began in New York By www.dailymail.co.uk Published On :: Sat, 09 May 2020 22:46:46 GMT There were 572 new hospitalizations due to coronavirus reported in New York on Friday, Gov. Andrew Cuomo said Saturday. This is the lowest number since the lockdown on March 20. Full Article
liz Recruiter Eliza Kirkby lists the three biggest mistakes job candidates make on social media By www.dailymail.co.uk Published On :: Sun, 10 May 2020 06:41:45 GMT An Australian recruiter has listed the three biggest mistakes job candidates make on social media that could cost them a career. Full Article
liz Elizabeth Day: 'I hate background music. Do you hear me?' By www.dailymail.co.uk Published On :: Sat, 03 Aug 2019 23:02:55 GMT While I was undergoing a life MOT, I realised there was one area I had overlooked - my hearing Full Article
liz LIZ JONES'S DIARY: In which I need a plus one By www.dailymail.co.uk Published On :: Sat, 03 Aug 2019 23:03:06 GMT The past week has got me wondering. Do we date men in order to have a plus one? Full Article
liz LIZ JONES'S DIARY: The dreaded Devon wedding, part 1 By www.dailymail.co.uk Published On :: Sat, 17 Aug 2019 23:03:24 GMT I decided not to invite David to my friend's wedding, partly because he was away at a party in France but also because I couldn't afford to have yet another expensive mini-break ruined Full Article
liz Elizabeth Day: 'Staying friends with your ex… discuss' By www.dailymail.co.uk Published On :: Sat, 17 Aug 2019 23:03:28 GMT My boyfriend J can't understand why I keep in touch with former lovers when he isn't in touch with any of his. It's become something of a joke between us... Full Article
liz Liz Jones goes to mermaid school: Our intrepid columnist dives into a bizarre way of life By www.dailymail.co.uk Published On :: Sat, 24 Aug 2019 23:02:51 GMT Believe it or not, it's a thing. But 'mermaiding' runs far deeper than simply dressing up in a silicone tail. So what's the big pull? Full Article
liz Elizabeth Day: Meghan's just doing what comes naturally By www.dailymail.co.uk Published On :: Sat, 24 Aug 2019 23:03:05 GMT I'm in Los Angeles at the moment. I advise you to look away now if the casual smugness of that opening sentence was too much to bear Full Article
liz LIZ JONES'S DIARY: The dreaded Devon wedding, part 2 By www.dailymail.co.uk Published On :: Sat, 24 Aug 2019 23:03:09 GMT It wasn't my best couple of days. Having had my face-lift outed over pre-wedding drinks at the Saunton Sands Wellness Spa, I got back to my little hotel on Friday night to find... Full Article
liz Shane Warne admits he's 'quite sad' about splitting from ex-fiancée Elizabeth Hurley By www.dailymail.co.uk Published On :: Sun, 10 May 2020 03:12:50 GMT He enjoyed a PDA-filled romance with UK actress Elizabeth Hurley between 2010 and 2013. Full Article
liz A common, invisibilized malady By indiatogether.org Published On :: Fri, 27 Oct 2017 10:32:58 +0000 October is domestic violence awareness month. Pushpa Achanta shares stories of victims of domestic violence to point out why the dilution of IPC Section 498A by the Supreme Court is a blow to the fight against domestic violence. Full Article
liz Radhika Madan Shares Her Biggest Learning From COVID-19 Crisis: Realizing The Value Of Basic Things By www.filmibeat.com Published On :: Fri, 08 May 2020 23:29:32 +0530 The Coronavirus crisis has left us all reevaluating our priorities in life. Bollywood celebrities too have had to pause their busy lives during the lockdown and spend time reflecting. Radhika Madan shared what has been the biggest learning from the crisis Full Article
liz In VE Day address, Queen Elizabeth praises Britian's response to coronavirus pandemic By www.newkerala.com Published On :: Sun, 10 May 2020 04:51:02 +0530 Full Article
liz The XML serialization of HTML5, aka ‘XHTML5’ By mathiasbynens.be Published On :: Thu, 17 Jun 2010 10:24:25 +0200 A while ago, I was wondering how exactly one triggers HTML5’s XML mode — let’s call it XHTML5 from now on. You know, just out of curiosity. I’ll always prefer HTML over XHTML because it’s much less verbose and I like to keep things simple. Full Article
liz Co-morbidity, late hospitalization ailing Gujarat: AIIMS chief | Ahmedabad News - Times of India By Published On :: Co-morbidity, late hospitalization ailing Gujarat: AIIMS chief | Ahmedabad News - Times of India Full Article
liz 'Co-morbidity, late hospitalization ailing Guj' By timesofindia.indiatimes.com Published On :: Sun, 10 May 2020 06:34:10 IST Director of All India Institute of Medical Sciences, Delhi (AIIMS-D), Dr Randeep Guleria on Saturday said that late hospitalization of Covid-19 patients due to fear of stigma and higher prevalence of co-morbid conditions like diabetes, hypertension, heart and kidney disease were key reasons behind the high number of Civid-19 deaths in Gujarat. Full Article
liz Device for source position stabilization and beam parameter monitoring at inverse Compton X-ray sources By scripts.iucr.org Published On :: 2019-08-07 Compact X-ray sources based on inverse Compton scattering provide brilliant and partially coherent X-rays in a laboratory environment. The cross section for inverse Compton scattering is very small, requiring high-power laser systems as well as small laser and electron beam sizes at the interaction point to generate sufficient flux. Therefore, these systems are very sensitive to distortions which change the overlap between the two beams. In order to monitor X-ray source position, size and flux in parallel to experiments, the beam-position monitor proposed here comprises a small knife edge whose image is acquired with an X-ray camera specifically designed to intercept only a very small fraction of the X-ray beam. Based on the source position drift recorded with the monitor, a closed-loop feedback stabilizes the X-ray source position by adjusting the laser beam trajectory. A decrease of long-term source position drifts by more than one order of magnitude is demonstrated with this device. Consequently, such a closed-loop feedback system which enables stabilization of source position drifts and flux of inverse Compton sources in parallel to experiments has a significant impact on the performance of these sources. Full Article text
liz Low-dose X-ray structure analysis of cytochrome c oxidase utilizing high-energy X-rays By scripts.iucr.org Published On :: 2019-06-14 To investigate the effect of high-energy X-rays on site-specific radiation-damage, low-dose diffraction data were collected from radiation-sensitive crystals of the metal enzyme cytochrome c oxidase. Data were collected at the Structural Biology I beamline (BL41XU) at SPring-8, using 30 keV X-rays and a highly sensitive pixel array detector equipped with a cadmium telluride sensor. The experimental setup of continuous sample translation using multiple crystals allowed the average diffraction weighted dose per data set to be reduced to 58 kGy, and the resulting data revealed a ligand structure featuring an identical bond length to that in the damage-free structure determined using an X-ray free-electron laser. However, precise analysis of the residual density around the ligand structure refined with the synchrotron data showed the possibility of a small level of specific damage, which might have resulted from the accumulated dose of 58 kGy per data set. Further investigation of the photon-energy dependence of specific damage, as assessed by variations in UV-vis absorption spectra, was conducted using an on-line spectrometer at various energies ranging from 10 to 30 keV. No evidence was found for specific radiation damage being energy dependent. Full Article text
liz ProQEXAFS: a highly optimized parallelized rapid processing software for QEXAFS data By scripts.iucr.org Published On :: 2020-02-07 The high temporal resolution in data acquisition, possible in the quick-scanning EXAFS (QEXAFS) mode of operation, provides new challenges in efficient data processing methods. Here a new approach is developed that combines an easy to use interactive graphical interface with highly optimized and fully parallelized Python-based routines for extracting, normalizing and interpolating oversampled time-resolved XAS spectra from a raw binary stream of data acquired during operando QEXAFS studies. The programs developed are freely available via a Github repository. Full Article text
liz Visualization Bench for the screening of crystallization assays and the automation of in situ experiments By journals.iucr.org Published On :: Full Article text
liz Redetermination of the crystal structure of BaTeO3(H2O), including the localization of the hydrogen atoms By scripts.iucr.org Published On :: 2019-05-31 The redetermination of the crystal structure of barium oxidotellurate(IV) monohydrate allowed the localization of the hydrogen atoms that were not determined in the previous study [Nielsen, Hazell & Rasmussen (1971). Acta Chem. Scand. 25, 3037–3042], thus making an unambiguous assignment of the hydrogen-bonding scheme possible. The crystal structure shows a layered arrangement parallel to (001), consisting of edge-sharing [BaO6(H2O)] polyhedra and flanked by isolated [TeO3] trigonal pyramids on the top and bottom. O—H⋯O hydrogen bonds of medium strength link adjacent layers along [001]. Full Article text
liz Zn and Ni complexes of pyridine-2,6-dicarboxylates: crystal field stabilization matters! By scripts.iucr.org Published On :: 2019-05-31 Six reaction products of ZnII and NiII with pyridine-2,6-dicarboxylic acid (H2Lig1), 4-chloropyridine-2,6-dicarboxylic acid (H2Lig2) and 4-hydroxypyridine-2,6-dicarboxylic acid (H2Lig3) are used to pinpoint the structural consequences of crystal field stabilization by an incomplete d shell. The pseudo-octahedral ZnII coordination sphere in bis(6-carboxypicolinato)zinc(II) trihydrate, [Zn(C7H4NO4)2]·3H2O or [Zn(HLig1)2]·3H2O, (1), is significantly less regular than that about NiII in the isostructural compound bis(6-carboxypicolinato)nickel(II) trihydrate, [Ni(C7H4NO4)2]·3H2O or [Ni(HLig1)2]·3H2O, (2). The ZnII complexes poly[(4-chloropyridine-2,6-dicarboxylato)zinc(II)], [Zn(C7H2ClNO4)]n or [Zn(Lig2)]n, (3), and poly[[(4-hydroxypyridine-2,6-dicarboxylato)zinc(II)] monohydrate], {[Zn(C7H3NO5)]·H2O}n or {[Zn(Lig3)]·H2O}n, (4), represent two-dimensional coordination polymers with chelating and bridging pyridine-2,6-dicarboxylate ligands in which the coordination polyhedra about the central cations cannot be associated with any regular shape; their coordination environments range between trigonal–bipyramidal and square-pyramidal geometries. In contrast, the corresponding adducts of the diprotonated ligands to NiII, namely triaqua(4-chloropyridine-2,6-dicarboxylato)nickel(II), [Ni(C7H2ClNO4)(H2O)3] or [NiLig2(OH2)3)], (5), and triaqua(4-hydroxypyridine-2,6-dicarboxylato)nickel(II) 1.7-hydrate, [Ni(C7H3NO5)(H2O)3]·1.7H2O or [NiLig3(OH2)3)]·1.7H2O, (6), feature rather regular octahedral coordination spheres about the transition-metal cations, thus precluding the formation of analogous extended structures. Full Article text
liz The `super acid' BF3H2O stabilized by 1,4-dioxane: new preparative aspects and the crystal structure of BF3H2O·C4H8O2 By scripts.iucr.org Published On :: 2019-10-31 Highly Brønsted-acidic boron trifluoride monohydrate, a widely used `super acid-catalyst', is a colourless fuming liquid that releases BF3 at room temperature. Compared to the liquid components, i.e. boron trifluoride monohydrate and 1,4-dioxane, their 1:1 adduct, BF3H2O·C4H8O2, is a solid with pronounced thermal stability (m.p. 401–403 K). The crystal structure of the long-time-stable easy-to-handle and weighable compound is reported along with new preparative aspects and the results of 1H, 11B, 13C and 19F spectroscopic investigations, particularly documenting its high Brønsted acidity in acetonitrile solution. The remarkable stability of solid BF3H2O·C4H8O2 is attributed to the chain structure established by O—H⋯O hydrogen bonds of exceptional strength {O2⋯H1—O1 [O⋯O = 2.534 (3) Å] and O1—H1⋯O3i [2.539 (3) Å] in the concatenating unit >O2⋯H1—O1—H2⋯O3i<}, taking into account the molecular (non-ionic) character of the structural moieties. Indirectly, this structural feature documents the outstanding acidification of the H2O molecule bound to BF3 and reflects the super acid nature of BF3H2O. In detail, the C22(7) zigzag chain system of hydrogen bonding in the title structure is characterized by the double hydrogen-bond donor and double (κO,κO') hydrogen-bond acceptor functionality of the aqua ligand and dioxane molecule, respectively, the almost equal strength of both hydrogen bonds, the approximatety linear arrangement of the dioxane O atoms and the two neighbouring water O atoms. Furthermore, the approximately planar arrangement of B, F and O atoms in sheets perpendicular to the c axis of the orthorhombic unit cell is a characteristic structural feature. Full Article text
liz An unusually short intermolecular N—H⋯N hydrogen bond in crystals of the hemi-hydrochloride salt of 1-exo-acetamidopyrrolizidine By scripts.iucr.org Published On :: 2020-01-01 The title compound [systematic name: (1R*, 8S)-2-acetamidooctahydropyrrolizin-4-ium chloride–N-[(1R, 8S)-hexahydro-1H-pyrrolizin-2-yl)acetamide (1/1)], 2(C9H16N2O)·HCl or C9H17N2O+·Cl−·C9H16N2O, arose as an unexpected product when 1-exo-acetamidopyrrolizidine (AcAP; C9H16N2O) was dissolved in CHCl3. Within the AcAP pyrrolizidine group, the unsubstituted five-membered ring is disordered over two orientations in a 0.897 (5):0.103 (5) ratio. Two AcAP molecules related by a crystallographic twofold axis link to H+ and Cl− ions lying on the rotation axis, thereby forming N—H⋯N and N—H⋯Cl⋯H—N hydrogen bonds. The first of these has an unusually short N⋯N separation of 2.616 (2) Å: refinement of different models against the present data set could not distinguish between a symmetrical hydrogen bond (H atom lying on the twofold axis and equidistant from the N atoms) or static or dynamic disorder models (i.e. N—H⋯N + N⋯H—N). Computational studies suggest that the disorder model is slightly more stable, but the energy difference is very small. Full Article text
liz Structural investigation of methyl 3-(4-fluorobenzoyl)-7-methyl-2-phenylindolizine-1-carboxylate, an inhibitory drug towards Mycobacterium tuberculosis By scripts.iucr.org Published On :: 2020-03-20 The title compound, C24H18FNO3, crystallizes in the monoclinic centrosymmetric space group P21/n and its molecular conformation is stabilized via C—H⋯O intramolecular interactions. The supramolecular network mainly comprises C—H⋯O, C—H⋯F and C—H⋯π interactions, which contribute towards the formation of the crystal structure. The different intermolecular interactions have been further analysed via Hirshfeld surface analysis and fingerprint plots. Full Article text
liz Functionalized 3-(5-aryloxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)-1-(4-substituted-phenyl)prop-2-en-1-ones: synthetic pathway, and the structures of six examples By scripts.iucr.org Published On :: 2020-04-21 Five examples each of 3-(5-aryloxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)-1-[4-(prop-2-yn-1-yloxy)phenyl]prop-2-en-1-ones and the corresponding 1-(4-azidophenyl)-3-(5-aryloxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)prop-2-en-1-ones have been synthesized in a highly efficient manner, starting from a common source precursor, and structures have been determined for three examples of each type. In each of 3-[5-(2-chlorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]-1-[4-(prop-2-yn-1-yloxy)phenyl]prop-2-en-1-one, C28H21ClN2O3, (Ib), the isomeric 3-[5-(2-chlorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]-1-[4-(prop-2-yn-1-yloxy)phenyl]prop-2-en-1-one, (Ic), and 3-[3-methyl-5-(naphthalen-2-yloxy)-1-phenyl-1H-pyrazol-4-yl]-1-[4-(prop-2-ynyloxy)phenyl]prop-2-en-1-one, C32H24N2O3, (Ie), the molecules are linked into chains of rings, formed by two independent C—H⋯O hydrogen bonds in (Ib) and by a combination of C—H⋯O and C—H⋯π(arene) hydrogen bonds in each of (Ic) and (Ie). There are no direction-specific intermolecular interactions in the structure of 1-(4-azidophenyl)-3-[3-methyl-5-(2-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]prop-2-en-1-one, C26H21N5O2, (IIa). In 1-(4-azidophenyl)-3-[5-(2,4-dichlorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]prop-2-en-1-one, C25H17Cl2N5O2, (IId), the dichlorophenyl group is disordered over two sets of atomic sites having occupancies 0.55 (4) and 0.45 (4), and the molecules are linked by a single C—H⋯O hydrogen bond to form cyclic, centrosymmetric R22(20) dimers. Similar dimers are formed in 1-(4-azidophenyl)-3-[3-methyl-5-(naphthalen-2-yloxy)-1-phenyl-1H-pyrazol-4-yl]prop-2-en-1-one, C29H21N5O2, (IIe), but here the dimers are linked into a chain of rings by two independent C—H..π(arene) hydrogen bonds. Comparisons are made between the molecular conformations within both series of compounds. Full Article text
liz Handbook of Industrial Crystallization. Third edition. Edited by Allan S. Myerson, Deniz Erdemir and Alfred Y. Lee. Cambridge University Press, 2019. Pp. 538. Price GBP 145 (hardcover). ISBN 9780521196185. By scripts.iucr.org Published On :: 2020-04-14 Full Article text
liz SVAT4: a computer program for visualization and analysis of crystal structures By scripts.iucr.org Published On :: 2020-05-05 SVAT4 is a computer program for interactive visualization of three-dimensional crystal structures, including chemical bonds and magnetic moments. A wide range of functions, e.g. revealing atomic layers and polyhedral clusters, are available for further structural analysis. Atomic sizes, colors, appearance, view directions and view modes (orthographic or perspective views) are adjustable. Customized work for the visualization and analysis can be saved and then reloaded. SVAT4 provides a template to simplify the process of preparation of a new data file. SVAT4 can generate high-quality images for publication and animations for presentations. The usability of SVAT4 is broadened by a software suite for simulation and analysis of electron diffraction patterns. Full Article text
liz Optimization of crystallization of biological macromolecules using dialysis combined with temperature control By scripts.iucr.org Published On :: 2020-05-05 A rational way to find the appropriate conditions to grow crystal samples for bio-crystallography is to determine the crystallization phase diagram, which allows precise control of the parameters affecting the crystal growth process. First, the nucleation is induced at supersaturated conditions close to the solubility boundary between the nucleation and metastable regions. Then, crystal growth is further achieved in the metastable zone – which is the optimal location for slow and ordered crystal expansion – by modulation of specific physical parameters. Recently, a prototype of an integrated apparatus for the rational optimization of crystal growth by mapping and manipulating temperature–precipitant–concentration phase diagrams has been constructed. Here, it is demonstrated that a thorough knowledge of the phase diagram is vital in any crystallization experiment. The relevance of the selection of the starting position and the kinetic pathway undertaken in controlling most of the final properties of the synthesized crystals is shown. The rational crystallization optimization strategies developed and presented here allow tailoring of crystal size and diffraction quality, significantly reducing the time, effort and amount of expensive protein material required for structure determination. Full Article text