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88661por Szychowski, Konrad A., Kaminskyy, Danylo V., Leja, Marcin L., Kryshchyshyn, Anna P., Lesyk, Roman B., Tobiasz, Jakub, Wnuk, Maciej, Pomianek, Tadeusz, Gmiński, Jan“…4-thiazolidinones, which are privileged structures in medicinal chemistry, comprise the well-known class of heterocycles and are a source of new drug-like compounds. …”
Publicado 2019
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88662por Sebbar, Nada Kheira, Hni, Brahim, Hökelek, Tuncer, Jaouhar, Abdelhakim, Labd Taha, Mohamed, Mague, Joel T., Essassi, El Mokhtar“…Hydrogen bonding and van der Waals interactions are the dominant interactions in the crystal packing. Computational chemistry calculations indicate that the two independent C—H(Bnz)⋯N(Prpnit) and C—H(Prpnit)⋯O(Thz) hydrogen bonds in the crystal impart about the same energy (ca 43 kJ mol(−1)). …”
Publicado 2019
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88663“…BACKGROUND: Isoxazole is an important pharmacophore in medicinal chemistry with a wide range of pharmacological activities. …”
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88664por Abdelhamid, Abdou O., El Sayed, Ibrahim E., Zaki, Yasser H., Hussein, Ahmed M., Mangoud, Mangoud M., Hosny, Mona A.“…In recent years, interest in the chemistry of hydrazonoyl halides has been renewed. 1,3,4-Thiadiazoles are one of the most common heterocyclic pharmacophores with a wide range of biological activities. …”
Publicado 2019
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88665por Elmansi, Heba, Nasr, Jenny Jeehan, Rageh, Azza H., El-Awady, Mohamed I., Hassan, Ghada S., Abdel-Aziz, Hatem A., Belal, Fathalla“…BACKGROUND: Lipophilicity is a physicochemical property of an essential importance in medicinal chemistry; therefore, fast and reliable measurement of lipophilicity will affect greatly the drug discovery process. …”
Publicado 2019
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88667por Vu, Bryan N., Sánchez, Odón, Bi, Jianzhao, Xiao, Qingyang, Hansel, Nadia N., Checkley, William, Gonzales, Gustavo F., Steenland, Kyle, Liu, Yang“…We combined aerosol optical depth (AOD), meteorological fields from the European Centre for Medium-Range Weather Forecasts (ECMWF), parameters from the Weather Research and Forecasting model coupled with Chemistry (WRF-Chem), and land use variables to fit a random forest model against ground measurements from 16 monitoring stations. …”
Publicado 2019
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88669“…Average yield with 60 minute bombardment using 4.5 µA current was 37 mCi and 21 mCi for [(18)F]F- and (18)FDG, respectively. Total 29 runs had chemistry or QC failures and were discarded. Remaining 516 batches were used to perform imaging upon 1370 patients (8±03 patients/day). …”
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88670por Loeven, Ashley M., Receno, Candace N., Cunningham, Caitlin M., DeRuisseau, Lara R.“…We hypothesized similar blood chemistry, breathing patterns, and cardiovascular responses with NO ISO and 1% ISO. …”
Publicado 2018
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88671por Cheng, Jun, Liu, Jian, Leng, Xuebing, Lohmiller, Thomas, Schnegg, Alexander, Bill, Eckhard, Ye, Shengfa, Deng, Liang“…While a large body of work has been devoted to mid- and high-valent iron imidos, to date the chemistry of iron(II) imidos has remained largely unexplored due to the difficulty in accessing them. …”
Publicado 2019
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88672“…Therefore, this technology for enumerating extremely large libraries of macrolide scaffolds could hold a unique potential in the field of computational chemistry and drug discovery for rational designing of new antibiotics and anti-cancer agents. …”
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88673por Melnik, Alexey V., Vázquez-Baeza, Yoshiki, Aksenov, Alexander A., Hyde, Embriette, McAvoy, Andrew C., Wang, Mingxun, da Silva, Ricardo R., Protsyuk, Ivan, Wu, Jason V., Bouslimani, Amina, Lim, Yan Wei, Luzzatto-Knaan, Tal, Comstock, William, Quinn, Robert A., Wong, Richard, Humphrey, Greg, Ackermann, Gail, Spivey, Timothy, Brouha, Sharon S., Bandeira, Nuno, Lin, Grace Y., Rohwer, Forest, Conrad, Douglas J., Alexandrov, Theodore, Knight, Rob, Dorrestein, Pieter C., Garg, Neha“…Additionally, the chemical diversity between locales in the lungs of the same individual sometimes exceeded interindividual variation. Thus, the chemistry and microbiome of the explanted lungs appear to be not only personalized but also regiospecific. …”
Publicado 2019
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88674por Brennecke, Philip, Rasina, Dace, Aubi, Oscar, Herzog, Katja, Landskron, Johannes, Cautain, Bastien, Vicente, Francisca, Quintana, Jordi, Mestres, Jordi, Stechmann, Bahne, Ellinger, Bernhard, Brea, Jose, Kolanowski, Jacek L., Pilarski, Radosław, Orzaez, Mar, Pineda-Lucena, Antonio, Laraia, Luca, Nami, Faranak, Zielenkiewicz, Piotr, Paruch, Kamil, Hansen, Espen, von Kries, Jens P., Neuenschwander, Martin, Specker, Edgar, Bartunek, Petr, Simova, Sarka, Leśnikowski, Zbigniew, Krauss, Stefan, Lehtiö, Lari, Bilitewski, Ursula, Brönstrup, Mark, Taskén, Kjetil, Jirgensons, Aigars, Lickert, Heiko, Clausen, Mads H., Andersen, Jeanette H., Vicent, Maria J., Genilloud, Olga, Martinez, Aurora, Nazaré, Marc, Fecke, Wolfgang, Gribbon, Philip“…Collectively, these findings highlight the benefits of small-molecule screening, the plethora of assay designs, and the close connection between screening and medicinal chemistry within EU-OPENSCREEN.…”
Publicado 2019
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88675“…Conducting polymers (CPs), especially polyaniline (PANI) based hybrid materials have emerged as very interesting materials for the adsorption of heavy metals and dyes from an aqueous environment due to their electrical transport properties, fascinating doping/de-doping chemistry and porous surface texture. Acid Blue 40 (AB40) is one of the common dyes present in the industrial effluents. …”
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88676por Kang, Hwi-Joong, Jeong, Mi-Kyung, Park, So-Jung, Jun, Hyeong-Joon, Yoo, Hwa-Seung“…All variables related to the safety assessment, such as vital signs, electrocardiography results, laboratory test results (CBC, chemistry, urine test), and adverse events, will be documented on the case report form (CRF) at every visit. …”
Publicado 2019
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88677por Taves, Sarah, Sun, Junjiang, Livingston, Eric W., Chen, Xin, Amiaud, Jerome, Brion, Regis, Hannah, William B., Bateman, Ted A., Heymann, Dominique, Monahan, Paul E.“…To further investigate the bone healing following hemarthrosis in hemophilia we examined a two week time course using microCT, serum chemistry, and histological analysis. Elevated ratio of osteoprotegerin (OPG)/receptor activator of nuclear factor-kappa B ligand (RANKL), increased osterix(+) osteoblastic cells, and decreased smoothness of the cortical bone surface were evident within several days of injury, indicative of acute heterotopic mineralization along the cortical surface. …”
Publicado 2019
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88678por Loren, Bradley P., Ewan, H. Samuel, Avramova, Larisa, Ferreira, Christina R., Sobreira, Tiago J. P., Yammine, Kathryn, Liao, Huiying, Cooks, R. Graham, Thompson, David H.“…DESI-MS high throughput experimentation (HTE) reaction evaluation significantly reduced the search space for flow chemistry optimization, thus representing a significant savings in time and materials to achieve a desired transformation with high efficiency.…”
Publicado 2019
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88679por LeClair, Amy, Concannon, Thomas, Kotzias, Virginia, Cole, Allison, Kwon, Simona, Lightfoot, Alexandra“…Participants came from the fields ranging from basic chemistry and drug development to infectious disease and pediatrics and represented both methodological and topical experts. …”
Publicado 2018
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88680“…Using the World Public Library Outline of Academic Disciplines as a guide, every author was assigned 1 of the following disciplines: Social Science (eg, Psychology), Basic Science (eg, Biology, Chemistry), Agriculture, Computer Science, Engineering, Medicine, Public Health, Nursing, or an Interdisciplinary field (eg, Genetic Medicine) based on their department and school affiliation. …”
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