845 results on '"Swart, M."'
Search Results
2. NWChem: Past, Present, and Future
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Aprà, E., Bylaska, E. J., de Jong, W. A., Govind, N., Kowalski, K., Straatsma, T. P., Valiev, M., van Dam, H. J. J., Alexeev, Y., Anchell, J., Anisimov, V., Aquino, F. W., Atta-Fynn, R., Autschbach, J., Bauman, N. P., Becca, J. C., Bernholdt, D. E., Bhaskaran-Nair, K., Bogatko, S., Borowski, P., Boschen, J., Brabec, J., Bruner, A., Cauët, E., Chen, Y., Chuev, G. N., Cramer, C. J., Daily, J., Deegan, M. J. O., Dunning Jr., T. H., Dupuis, M., Dyall, K. G., Fann, G. I., Fischer, S. A., Fonari, A., Früuchtl, H., Gagliardi, L., Garza, J., Gawande, N., Ghosh, S., Glaesemann, K., Götz, A. W., Hammond, J., Helms, V., Hermes, E. D., Hirao, K., Hirata, S., Jacquelin, M., Jensen, L., Johnson, B. G., Jónsson, H., Kendall, R. A., Klemm, M., Kobayashi, R., Konkov, V., Krishnamoorthy, S., Krishnan, M., Lin, Z., Lins, R. D., Littlefield, R. J., Logsdail, A. J., Lopata, K., Ma, W., Marenich, A. V., del Campo, J. Martin, Mejia-Rodriguez, D., Moore, J. E., Mullin, J. M., Nakajima, T., Nascimento, D. R., Nichols, J. A., Nichols, P. J., Nieplocha, J., de la Roza, A. Otero, Palmer, B., Panyala, A., Pirojsirikul, T., Peng, B., Peverati, R., Pittner, J., Pollack, L., Richard, R. M., Sadayappan, P., Schatz, G. C., Shelton, W. A., Silverstein, D. W., Smith, D. M. A., Soares, T. A., Song, D., Swart, M., Taylor, H. L., Thomas, G. S., Tipparaju, V., Truhlar, D. G., Tsemekhman, K., Van Voorhis, T., Vázquez-Mayagoitia, Á., Verma, P., Villa, O., Vishnu, A., Vogiatzis, K. D., Wang, D., Weare, J. H., Williamson, M. J., Windus, T. L., Woliński, K., Wong, A. T., Wu, Q., Yang, C., Yu, Q., Zacharias, M., Zhang, Z., Zhao, Y., and Harrison, R. J.
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Physics - Chemical Physics ,Physics - Computational Physics - Abstract
Specialized computational chemistry packages have permanently reshaped the landscape of chemical and materials science by providing tools to support and guide experimental efforts and for the prediction of atomistic and electronic properties. In this regard, electronic structure packages have played a special role by using first-principledriven methodologies to model complex chemical and materials processes. Over the last few decades, the rapid development of computing technologies and the tremendous increase in computational power have offered a unique chance to study complex transformations using sophisticated and predictive many-body techniques that describe correlated behavior of electrons in molecular and condensed phase systems at different levels of theory. In enabling these simulations, novel parallel algorithms have been able to take advantage of computational resources to address the polynomial scaling of electronic structure methods. In this paper, we briefly review the NWChem computational chemistry suite, including its history, design principles, parallel tools, current capabilities, outreach and outlook., Comment: This article appeared in volume 152, issue 18, page 184102 of the Journal of Chemical Physics. It can be found at https://doi.org/10.1063/5.0004997
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- 2020
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3. NWChem: Past, present, and future
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Aprà, E, Bylaska, EJ, De Jong, WA, Govind, N, Kowalski, K, Straatsma, TP, Valiev, M, Van Dam, HJJ, Alexeev, Y, Anchell, J, Anisimov, V, Aquino, FW, Atta-Fynn, R, Autschbach, J, Bauman, NP, Becca, JC, Bernholdt, DE, Bhaskaran-Nair, K, Bogatko, S, Borowski, P, Boschen, J, Brabec, J, Bruner, A, Cauët, E, Chen, Y, Chuev, GN, Cramer, CJ, Daily, J, Deegan, MJO, Dunning, TH, Dupuis, M, Dyall, KG, Fann, GI, Fischer, SA, Fonari, A, Früchtl, H, Gagliardi, L, Garza, J, Gawande, N, Ghosh, S, Glaesemann, K, Götz, AW, Hammond, J, Helms, V, Hermes, ED, Hirao, K, Hirata, S, Jacquelin, M, Jensen, L, Johnson, BG, Jónsson, H, Kendall, RA, Klemm, M, Kobayashi, R, Konkov, V, Krishnamoorthy, S, Krishnan, M, Lin, Z, Lins, RD, Littlefield, RJ, Logsdail, AJ, Lopata, K, Ma, W, Marenich, AV, Martin Del Campo, J, Mejia-Rodriguez, D, Moore, JE, Mullin, JM, Nakajima, T, Nascimento, DR, Nichols, JA, Nichols, PJ, Nieplocha, J, Otero-De-La-Roza, A, Palmer, B, Panyala, A, Pirojsirikul, T, Peng, B, Peverati, R, Pittner, J, Pollack, L, Richard, RM, Sadayappan, P, Schatz, GC, Shelton, WA, Silverstein, DW, Smith, DMA, Soares, TA, Song, D, Swart, M, Taylor, HL, Thomas, GS, Tipparaju, V, Truhlar, DG, Tsemekhman, K, Van Voorhis, T, Vázquez-Mayagoitia, A, Verma, P, Villa, O, and Vishnu, A
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physics.chem-ph ,physics.comp-ph ,Physical Sciences ,Chemical Sciences ,Engineering ,Chemical Physics - Abstract
Specialized computational chemistry packages have permanently reshaped the landscape of chemical and materials science by providing tools to support and guide experimental efforts and for the prediction of atomistic and electronic properties. In this regard, electronic structure packages have played a special role by using first-principle-driven methodologies to model complex chemical and materials processes. Over the past few decades, the rapid development of computing technologies and the tremendous increase in computational power have offered a unique chance to study complex transformations using sophisticated and predictive many-body techniques that describe correlated behavior of electrons in molecular and condensed phase systems at different levels of theory. In enabling these simulations, novel parallel algorithms have been able to take advantage of computational resources to address the polynomial scaling of electronic structure methods. In this paper, we briefly review the NWChem computational chemistry suite, including its history, design principles, parallel tools, current capabilities, outreach, and outlook.
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- 2020
4. Photosensitivity and self‐induction in patients aged 50 and older
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van Asch, C. J. J., primary, Spetgens, W. P. J., additional, Bourez‐Swart, M. D., additional, Meppelink, A. M., additional, Deckers, C. L. P., additional, van Blooijs, D., additional, and Kasteleijn‐Nolst Trenité, D. G. A., additional
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- 2024
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5. Extraction of Multiple Value-Added Compounds from Agricultural Biomass Waste: A Review
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Chimphango, A. F. A., Mugwagwa, L. R., Swart, M., Daramola, Michael O., editor, and Ayeni, Augustine O., editor
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- 2020
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6. Shared decision making for high-risk surgery
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Barnett, G. and Swart, M.
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- 2021
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7. Aligning Event Risk Management with the Sustainable Development Goals
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Louw, L. B., primary, Esterhuyzen, E., additional, and Swart, M. P., additional
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- 2022
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8. Photosensitivity and self-induction in patients aged 50 and older
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Genetica, van Asch, C. J.J., Spetgens, W. P.J., Bourez-Swart, M. D., Meppelink, A. M., Deckers, C. L.P., van Blooijs, D., Kasteleijn-Nolst Trenité, D. G.A., Genetica, van Asch, C. J.J., Spetgens, W. P.J., Bourez-Swart, M. D., Meppelink, A. M., Deckers, C. L.P., van Blooijs, D., and Kasteleijn-Nolst Trenité, D. G.A.
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- 2024
9. Unwarranted variation and the goal of net zero for the NHS in England: exploring the link between efficiency working, patient outcomes and carbon footprint
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van Hove, M., primary, John, J. B., additional, Ojelade, E., additional, Ayyaz, F., additional, Koris, J., additional, Frame, J., additional, Swart, M., additional, Snowden, C., additional, Briggs, T. W. R., additional, and Gray, W. K., additional
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- 2024
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10. Photosensitivity and self‐induction in patients aged 50 and older
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Asch, C. J. J., Spetgens, W. P. J., Bourez‐Swart, M. D., Meppelink, A. M., Deckers, C. L. P., Blooijs, D., and Kasteleijn‐Nolst Trenité, D. G. A.
- Abstract
Photosensitivity is known to occur predominantly in children and adolescents and with a clear female predominance. Little is known on the prevalence of photosensitivity in older patients (50+) and its phenotypical appearance. A retrospective observational study was performed investigating the prevalence of a photoparoxysmal EEG response (PPR) on at least one EEG during the period 2015–2021. Data were gathered from patients aged 50 years and older by retrieving clinical and EEG characteristics from existing medical records. Data on photosensitivity‐related symptoms in daily life were gathered with telephone interviewing. In 248 patients a PPR had been elicited, of whom 16 patients (6.5%) were 50 years or older. In older patients, photosensitivity was a persistent feature of childhood‐onset epilepsy (n= 8), of adult‐onset epilepsy (n= 7), or an incidental finding (n= 1). In the 50+ group, 56% of photosensitive patients was female, whereas 72% in the total PPR‐group. In six of 16 older patients, eye closure sensitivity was observed; two of these patients reported self‐induction. Symptoms of photosensitivity in daily life were present in eight out of nine patients who consented in a telephone interview. For seven of these patients, wearing sunglasses was helpful. Female preponderance for photosensitivity was not found in epilepsy patients of 50 years and older. In 44% of the older photosensitive patients in this series, the PPR was a feature of adult‐onset epilepsy. Symptoms of photosensitivity in daily life in older patients with epilepsy seem comparable to those in younger patients, and thus worthwhile to diagnose and treat them equally.
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- 2024
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11. Extraction of Multiple Value-Added Compounds from Agricultural Biomass Waste: A Review
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Chimphango, A. F. A., primary, Mugwagwa, L. R., additional, and Swart, M., additional
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- 2020
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12. Inter-observer reliability of preoperative cardiopulmonary exercise test interpretation: a cross-sectional study
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Abbott, T., MacDonald, N., Gooneratne, M., Raj, A., Rooms, M., Nicol, M., Koutra, M., Halworth, S., Wilkins, K., Nevin, D., Gaultry, E., Otto, J., Bell, D., Hardy, M., Prabhu, P., Ravishankar, R., Correia, J., Beilstein, C., Greaves, K., James, S., Tighe, H., Perks, J., Pennington, J., Pritchard, A., Moxon, P., Brown, K., Swart, M., Carlisle, J., Abbott, T.E.F., McNeill, J., Lee, A., Levett, D.Z.H., and Grocott, M.P.W.
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- 2018
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13. Perioperative cardiopulmonary exercise testing (CPET): consensus clinical guidelines on indications, organization, conduct, and physiological interpretation
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Levett, D.Z.H., Jack, S., Swart, M., Carlisle, J., Wilson, J., Snowden, C., Riley, M., Danjoux, G., Ward, S.A., Older, P., and Grocott, M.P.W.
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- 2018
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14. Why women are not small men: sex-related differences in perioperative cardiopulmonary exercise testing
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Thomas, G., West, M. A., Browning, M., Minto, G., Swart, M., Richardson, K., McGarrity, L., Jack, S., Grocott, M. P. W., and Levett, D. Z. H.
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- 2020
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15. The emerging specialty of perioperative medicine: a UK survey of the attitudes and behaviours of anaesthetists
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Partridge, J. S. L., Rogerson, A., Joughin, A. L., Walker, D., Simon, J., Swart, M., and Dhesi, J. K.
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- 2020
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16. Conservation Implications of Genetic Differentiation in Southern African Populations of Black Rhinoceros (Diceros bicornis)
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Swart, M. K. J. and Ferguson, J. W. H.
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- 1997
17. Age and the anaesthetist: considerations for the individual anaesthetist and workforce planning
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Davies, M., primary, Clyburn, P., additional, Barker, P., additional, Flatt, N., additional, Noble, N., additional, Swart, M., additional, Redfern, N., additional, Davidson, R., additional, Fleming, R., additional, Stacey, K., additional, and Richards, C., additional
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- 2022
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18. Correction to: Cardiopulmonary exercise testing (CPET) in the United Kingdom—a national survey of the structure, conduct, interpretation and funding
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Reeves, T., Bates, S., Sharp, T., Richardson, K., Bali, S., Plumb, J., Anderson, H., Prentis, J., Swart, M., Levett, D. Z. H., and on behalf of Perioperative Exercise Testing and Training Society (POETTS)
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- 2018
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19. Cardiopulmonary exercise testing (CPET) in the United Kingdom—a national survey of the structure, conduct, interpretation and funding
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Reeves, T., Bates, S., Sharp, T., Richardson, K., Bali, S., Plumb, J., Anderson, H., Prentis, J., Swart, M., Levett, D. Z. H., and on behalf of Perioperative Exercise Testing and Training Society (POETTS)
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- 2018
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20. ESICM LIVES 2016: part three: Milan, Italy. 1–5 October 2016
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Velasquez, T., Mackey, G., Lusk, J., Kyle, U. G., Fontenot, T., Marshall, P., Shekerdemian, L. S., Coss-Bu, J. A., Nishigaki, A., Yatabe, T., Tamura, T., Yamashita, K., Yokoyama, M., Ruiz-Rodriguez, J. C., Encina, B., Belmonte, R., Troncoso, I., Tormos, P., Riveiro, M., Baena, J., Sanchez, A., Bañeras, J., Cordón, J., Duran, N., Ruiz, A., Caballero, J., Nuvials, X., Riera, J., Serra, J., Rutten, A. M. F., van Ieperen, S. N. M., Der Kinderen, E. P. H. M., Van Logten, T., Kovacikova, L., Skrak, P., Zahorec, M., Kyle, U. G., Akcan-Arikan, A., Silva, J. C., Mackey, G., Lusk, J., Goldsworthy, M., Shekerdemian, L. S., Coss-Bu, J. A., Wood, D., Harrison, D., Parslow, R., Davis, P., Pappachan, J., Goodwin, S., Ramnarayan, P., Chernyshuk, S., Yemets, H., Zhovnir, V., Pulitano’, S. M., De Rosa, S., Mancino, A., Villa, G., Tosi, F., Franchi, P., Conti, G., Patel, B., Khine, H., Shah, A., Sung, D., Singer, L., Haghbin, S., Inaloo, S., Serati, Z., Idei, M., Nomura, T., Yamamoto, N., Sakai, Y., Yoshida, T., Matsuda, Y., Yamaguchi, Y., Takaki, S., Yamaguchi, O., Goto, T., Longani, N., Medar, S., Abdel-Aal, I. R., El Adawy, A. S., Mohammed, H. M. E. H., Mohamed, A. N., Parry, S. M., Knight, L. D., Denehy, L., De Morton, N., Baldwin, C. E., Sani, D., Kayambu, G., da Silva, V. Z. M., Phongpagdi, P., Puthucheary, Z. A., Granger, C. L., Rydingsward, J. E., Horkan, C. M., Christopher, K. B., McWilliams, D., Jones, C., Reeves, E., Atkins, G., Snelson, C., Aitken, L. M., Rattray, J., Kenardy, J., Hull, A. M., Ullman, A., Le Brocque, R., Mitchell, M., Davis, C., Macfarlane, B., Azevedo, J. C., Rocha, L. L., De Freitas, F. F. M., Cavalheiro, A. M., Lucinio, N. M., Lobato, M. S., Ebeling, G., Kraegpoeth, A., Laerkner, E., De Brito-Ashurst, I., White, C., Gregory, S., Forni, L. G., Flowers, E., Curtis, A., Wood, C. A., Siu, K., Venkatesan, K., Muhammad, J. B. H., Ng, L., Seet, E., Baptista, N., Escoval, A., Tomas, E., Agrawal, R., Mathew, R., Varma, A., Dima, E., Charitidou, E., Perivolioti, E., Pratikaki, M., Vrettou, C., Giannopoulos, A., Zakynthinos, S., Routsi, C., Atchade, E., Houzé, S., Jean-Baptiste, S., Thabut, G., Genève, C., Tanaka, S., Lortat-Jacob, B., Augustin, P., Desmard, M., Montravers, P., de Molina, F. J. González, Barbadillo, S., Alejandro, R., Álvarez-Lerma, F., Vallés, J., Catalán, R. M., Palencia, E., Jareño, A., Granada, R. M., Ignacio, M. L., Cui, N., Liu, D., Wang, H., Su, L., Qiu, H., Li, R., Jaffal, K., Rouzé, A., Poissy, J., Sendid, B., Nseir, S., Paramythiotou, E., Rizos, M., Frantzeskaki, F., Antoniadou, A., Vourli, S., Zerva, L., Armaganidis, A., Riera, J., Gottlieb, J., Greer, M., Wiesner, O., Martínez, M., Acuña, M., Rello, J., Welte, T., Atchade, E., Mignot, T., Houzé, S., Jean-Baptiste, S., Thabut, G., Lortat-Jacob, B., Tanaka, S., Augustin, P., Desmard, M., Montravers, P., Soussi, S., Dudoignon, E., Ferry, A., Chaussard, M., Benyamina, M., Alanio, A., Touratier, S., Chaouat, M., Lafaurie, M., Mimoun, M., Mebazaa, A., Legrand, M., Sheils, M. A., Patel, C., Mohankumar, L., Akhtar, N., Noriega, S. K. Pacheco, Aldana, N. Navarrete, León, J. L. Ávila, Baquero, J. Durand, Bernal, F. Fernández, Ahmadnia, E., Hadley, J. S., Millar, M., Hall, D., Hewitt, H., Yasuda, H., Sanui, M., Komuro, T., Kawano, S., Andoh, K., Yamamoto, H., Noda, E., Hatakeyama, J., Saitou, N., Okamoto, H., Kobayashi, A., Takei, T., Matsukubo, S., Rotzel, H. B., Lázaro, A. Serrano, Prada, D. Aguillón, Gimillo, M. Rodriguez, Barinas, O. Diaz, Cortes, M. L. Blasco, Franco, J. Ferreres, Roca, J. M. Segura, Carratalá, A., Gonçalves, B., Turon, R., Mendes, A., Miranda, F., Mata, P. J., Cavalcanti, D., Melo, N., Lacerda, P., Kurtz, P., Righy, C., Rosario, L. E. de la Cruz, Lesmes, S. P. Gómez, Romero, J. C. García, Herrera, A. N. García, Pertuz, E. D. Díaz, Sánchez, M. J. Gómez, Sanz, E. Regidor, Hualde, J. Barado, Hernández, A. Ansotegui, Irazabal, J. M. Guergué, Spatenkova, V., Bradac, O., Suchomel, P., Urli, T., Lazzeri, E. Heusch, Aspide, R., Zanello, M., Perez-Borrero, L., Garcia-Alvarez, J. M., Arias-Verdu, M. D., Aguilar-Alonso, E., Rivera-Fernandez, R., Mora-Ordoñez, J., De La Fuente-Martos, C., Castillo-Lorente, E., Guerrero-Lopez, F., Lesmes, S. P. Gómez, Rosario, L. E. De la Cruz, Pertuz, E. D. Díaz, Hernández, A. Ansotegui, Romero, J. C. García, Sánchez, M. J. Gómez, Herrera, A. N. García, Ramírez, J. Roldán, Sanz, E. Regidor, Hualde, J. Barado, León, J. P. Tirapu, Navarro-Guillamón, L., Cordovilla-Guardia, S., Iglesias-Santiago, A., Guerrero-López, F., Fernández-Mondéjar, E., Vidal, A., Perez, M., Juez, A., Arias, N., Colino, L., Perez, J. L., Pérez, H., Calpe, P., Alcala, M. A., Robaglia, D., Perez, C., Lan, S. K., Cunha, M. M., Moreira, T., Santos, F., Lafuente, E., Fernandes, M. J., Silva, J. G., Rosario, L. E. de la Cruz, Lesmes, S. P. Gómez, Herrera, A. N. García, Romero, J. C. García, Pertuz, E. D. Díaz, Sánchez, M. J. Gómez, Sanz, E. Regidor, Echeverría, J. G. Armando, Hernández, A. Ansotegui, Hualde, J. Barado, Podlepich, V., Sokolova, E., Alexandrova, E., Lapteva, K., Kurtz, P., Shuinotsuka, C., Rabello, L., Vianna, G., Reis, A., Cairus, C., Salluh, J., Bozza, F., Torres, J. C. Barrios, Araujo, N. J. Fernández, García-Olivares, P., Keough, E., Dalorzo, M., Tang, L. K., De Sousa, I., Díaz, M., Marcos-Zambrano, L. J., Guerrero, J. E., Gomez, S. E. Zamora, Lopez, G. D. Hernandez, Cuellar, A. I. Vazquez, Nieto, O. R. Perez, Gonzalez, J. A. Castanon, Bhasin, D., Rai, S., Singh, H., Gupta, O., Bhattal, M. K., Sampley, S., Sekhri, K., Nandha, R., Aliaga, F. A., Olivares, F., Appiani, F., Farias, P., Alberto, F., Hernández, A., Pons, S., Sonneville, R., Bouadma, L., Neuville, M., Mariotte, E., Radjou, A., Lebut, J., Chemam, S., Voiriot, G., Dilly, M. P., Mourvillier, B., Dorent, R., Nataf, P., Wolff, M., Timsit, J. F., Ediboglu, O., Ataman, S., Ozkarakas, H., Kirakli, C., Vakalos, A., Avramidis, V., Obukhova, O., Kurmukov, I. A., Kashiya, S., Golovnya, E., Baikova, V. N., Ageeva, T., Haritydi, T., Kulaga, E. V., Rios-Toro, J. J., Perez-Borrero, L., Aguilar-Alonso, E., Arias-Verdu, M. D., Garcia-Alvarez, J. M., Lopez-Caler, C., De La Fuente-Martos, C., Rodriguez-Fernandez, S., Sanchez-Orézzoli, M. Gomez, Martin-Gallardo, F., Nikhilesh, J., Joshi, V., Villarreal, E., Ruiz, J., Gordon, M., Quinza, A., Gimenez, J., Piñol, M., Castellanos, A., Ramirez, P., Jeon, Y. D., Jeong, W. Y., Kim, M. H., Jeong, I. Y., Ahn, M. Y., Ahn, J. Y., Han, S. H., Choi, J. Y., Song, Y. G., Kim, J. M., Ku, N. S., Shah, H., Kellner, F., Rezai, F., Mistry, N., Yodice, P., Ovnanian, V., Fless, K., Handler, E., Alejos, R. Martínez, Romeu, J. D. Martí, Antón, D. González, Quinart, A., Martí, A. Torres, Llaurado-Serra, M., Lobo-Civico, A., Ventura-Rosado, A., Piñol-Tena, A., Pi-Guerrero, M., Paños-Espinosa, C., Peralvo-Bernat, M., Marine-Vidal, J., Gonzalez-Engroba, R., Montesinos-Cerro, N., Treso-Geira, M., Valeiras-Valero, A., Martinez-Reyes, L., Sandiumenge, A., Jimenez-Herrera, M. F., Helyar, S., Riozzi, P., Noon, A., Hallows, G., Cotton, H., Keep, J., Hopkins, P. A., Taggu, A., Renuka, S., Sampath, S., Rood, P. J. T., Frenzel, T., Verhage, R., Bonn, M., Pickkers, P., van der Hoeven, J. G., van den Boogaard, M., Corradi, F., Melnyk, L., Moggia, F., Pienovi, R., Adriano, G., Brusasco, C., Mariotti, L., Lattuada, M., Bloomer, M. J., Coombs, M., Ranse, K., Endacott, R., Maertens, B., Blot, K., Blot, S., Amerongen, M. P. van Nieuw, van der Heiden, E. S., Twisk, J. W. R., Girbes, A. R. J., Spijkstra, J. J., Riozzi, P., Helyar, S., Cotton, H., Hallows, G., Noon, A., Bell, C., Peters, K., Feehan, A., Keep, J., Hopkins, P. A., Churchill, K., Hawkins, K., Brook, R., Paver, N., Endacott, R., Maistry, N., van Wijk, A., Rouw, N., van Galen, T., Evelein-Brugman, S., Taggu, A., Krishna, B., Sampath, S., Putzu, A., Fang, M., Berto, M. Boscolo, Belletti, A., Cassina, T., Cabrini, L., Mistry, M., Alhamdi, Y., Welters, I., Abrams, S. T., Toh, C. H., Han, H. S., Gil, E. M., Lee, D. S., Park, C. M., Winder-Rhodes, S., Lotay, R., Doyle, J., Ke, M. W., Huang, W. C., Chiang, C. H., Hung, W. T., Cheng, C. C., Lin, K. C., Lin, S. C., Chiou, K. R., Wann, S. R., Shu, C. W., Kang, P. L., Mar, G. Y., Liu, C. P., Dubó, S., Aquevedo, A., Jibaja, M., Berrutti, D., Labra, C., Lagos, R., García, M. F., Ramirez, V., Tobar, M., Picoita, F., Peláez, C., Carpio, D., Alegría, L., Hidalgo, C., Godoy, K., Bakker, J., Hernández, G., Sadamoto, Y., Katabami, K., Wada, T., Ono, Y., Maekawa, K., Hayakawa, M., Sawamura, A., Gando, S., Marin-Mateos, H., Perez-Vela, J. L., Garcia-Gigorro, R., Peiretti, M. A. Corres, Lopez-Gude, M. 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J., Gonzalez, C. A., Pinto, J. L., Orozco, V., Patiño, J. A., Garcia, P. K., Contreras, K. M., Rodriguez, P., Echeverri, J. E., GETGAG Working Group, JSEPTIC (Japanese Society of Education for Physicians and Trainees in Intensive Care) Clinical Trial Group, CAPCRI Study, for the ReVA Research Network and the PROVE Network Investigators, from the FROG ICU Investigators, The WIND study group, Plug Working Group, GETGAG/SEMICYUC, AKI Research Group, St George’s University of London, IPREA Study Group, FINNRESUSCI Study Group, PICS- HCPA: Programa Intrahospitalar de Combate à Sepse do Hospital de Clínicas de Porto Alegre, ENVIN-HELICS Study Group, ARIAM registry of adult cardiac surgery, The Rapid Diagnosis of Infections in the Critically Ill Team, Tokyo Womens Medical University, PLUG working group, PLUG Working Group, On behalf of Okayama Research Investigation Organizing Network (ORION)investigators, PS-ICU Group, Japan Septic Disseminated Intravascular Coagulation (JSEPTIC DIC) study group, Student Research Committee - Shiraz University of Medical Sciences, ARIAM-ANDALUCIA, The WIND study group, PLUG Working Group, The WIND study group, PLUG Working Group, and Plug working group
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- 2016
- Full Text
- View/download PDF
21. NCV3 Life Orientation: Life Skills FG
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M Swart, M Hairbottle, A Pelser
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- 2014
22. NCV4 Life Orientation: Life Skills FG
- Author
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M Swart, M Hairbottle
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- 2014
23. Using predicted 30 day mortality to plan postoperative colorectal surgery care: a cohort study†
- Author
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Swart, M., Carlisle, J. B., and Goddard, J.
- Published
- 2017
- Full Text
- View/download PDF
24. NCV3 Life Orientation: Life Skills
- Author
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M Swart, M Hairbottle, A Pelser
- Published
- 2013
25. NCV2 Life Orientation: Life Skills FG
- Author
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M Swart, M Hairbottle, A Pelser
- Published
- 2012
26. NCV2 Life Orientation: Life Skills
- Author
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M Swart, M Hairbottle, A Pelser
- Published
- 2012
27. Validation of preoperative cardiopulmonary exercise testing-derived variables to predict in-hospital morbidity after major colorectal surgery
- Author
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West, M. A., Asher, R., Browning, M., Minto, G., Swart, M., Richardson, K., McGarrity, L., Jack, S., and Grocott, M. P. W.
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- 2016
- Full Text
- View/download PDF
28. Specialist pre-operative assessment clinics
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Dhesi, J. K. and Swart, M.
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- 2016
- Full Text
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29. Development and internal validation of a model for postoperative morbidity in adults undergoing major elective colorectal surgery: the peri‐operative quality improvement programme (PQIP) colorectal risk model.
- Author
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Bedford, J., Martin, P., Crowe, S., Wagstaff, D., Santos, C., Singleton, G., Baumber, R., Vindrola‐Padros, C., Vohra, R., Swart, M., Oliver, C. M., Dorey, J., Leeman, I., Moonesinghe, S. R., Moonesinghe, S. Ramani, Wagstaff, Duncan, Bedford, James, Sahni, Arun, McGuckin, Dermot, and Gilhooly, David
- Abstract
Summary: Over 1.5 million major surgical procedures take place in the UK NHS each year and approximately 25% of patients develop at least one complication. The most widely used risk‐adjustment model for postoperative morbidity in the UK is the physiological and operative severity score for the enumeration of mortality and morbidity. However, this model was derived more than 30 years ago and now overestimates the risk of morbidity. In addition, contemporary definitions of some model predictors are markedly different compared with when the tool was developed. A second model used in clinical practice is the American College of Surgeons National Surgical Quality Improvement Programme risk model; this provides a risk estimate for a range of postoperative complications. This model, widely used in North America, is not open source and therefore cannot be applied to patient populations in other settings. Data from a prospective multicentre clinical dataset of 118 NHS hospitals (the peri‐operative quality improvement programme) were used to develop a bespoke risk‐adjustment model for postoperative morbidity. Patients aged ≥ 18 years who underwent colorectal surgery were eligible for inclusion. Postoperative morbidity was defined using the postoperative morbidity survey at postoperative day 7. Thirty‐one candidate variables were considered for inclusion in the model. Death or morbidity occurred by postoperative day 7 in 3098 out of 11,646 patients (26.6%). Twelve variables were incorporated into the final model, including (among others): Rockwood clinical frailty scale; body mass index; and index of multiple deprivation quintile. The C‐statistic was 0.672 (95%CI 0.660–0.684), with a bootstrap optimism corrected C‐statistic of 0.666 at internal validation. The model demonstrated good calibration across the range of morbidity estimates with a mean slope gradient of predicted risk of 0.959 (95%CI 0.894–1.024) with an index‐corrected intercept of −0.038 (95%CI −0.112–0.036) at internal validation. Our model provides parsimonious case‐mix adjustment to quantify risk of morbidity on postoperative day 7 for a UK population of patients undergoing major colorectal surgery. Despite the C‐statistic of < 0.7, our model outperformed existing risk‐models in widespread use. We therefore recommend application in case‐mix adjustment, where incorporation into a continuous monitoring tool such as the variable life adjusted display or exponentially‐weighted moving average‐chart could support high‐level monitoring and quality improvement of risk‐adjusted outcome at the population level. [ABSTRACT FROM AUTHOR]
- Published
- 2022
- Full Text
- View/download PDF
30. Safety of day‐case paediatric tonsillectomy in England: an analysis of administrative data for the Getting It Right First Time programme
- Author
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Gray, W. K., primary, Takhar, A. S., additional, Navaratnam, A. V., additional, Day, J., additional, Swart, M., additional, Snowden, C., additional, Briggs, T. W. R., additional, and Marshall, A., additional
- Published
- 2021
- Full Text
- View/download PDF
31. P14.40 Trends in distribution of glioblastoma care and patient’s travel distance; results from the Dutch Brain Tumor Registry
- Author
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De Swart, M E, primary, Ho, V K Y, additional, Lagerwaard, F J, additional, Brandsma, D, additional, Broen, M P, additional, French, P, additional, Gijtenbeek, A, additional, Geurts, M, additional, Hanse, M C J, additional, Idema, B, additional, Klein, M, additional, Koekkoek, J A F, additional, Polman, S K, additional, Samuels, C W, additional, Seute, T, additional, Sijben, A E J, additional, Smits, M, additional, Vos, M J, additional, Walenkamp, A M E, additional, Wesseling, P, additional, De Witt Hamer, P C, additional, and Kouwenhoven, M C M, additional
- Published
- 2021
- Full Text
- View/download PDF
32. P14.31 Between hospital variation in timings to multidisciplinary glioblastoma care in the Dutch Brain Tumor Registry
- Author
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De Swart, M E, primary, Ho, V K Y, additional, Lagerwaard, F J, additional, Brandsma, D, additional, Broen, M P, additional, French, P, additional, Gijtenbeek, A, additional, Geurts, M, additional, Hanse, M C J, additional, Idema, B, additional, Klein, M, additional, Koekkoek, J A F, additional, Polman, S K, additional, Samuels, C W, additional, Seute, T, additional, Sijben, A E J, additional, Smits, M, additional, Vos, M J, additional, Walenkamp, A M E, additional, Wesseling, P, additional, Kouwenhoven, M C M, additional, and De Witt Hamer, P C, additional
- Published
- 2021
- Full Text
- View/download PDF
33. Validation of long-term survival prediction for scheduled abdominal aortic aneurysm repair with an independent calculator using only pre-operative variables
- Author
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Carlisle, J. B., Danjoux, G., Kerr, K., Snowden, C., and Swart, M.
- Published
- 2015
- Full Text
- View/download PDF
34. Use of a pathway quality improvement care bundle to reduce mortality after emergency laparotomy
- Author
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Huddart, S., Peden, C. J., Swart, M., McCormick, B., Dickinson, M., Mohammed, M. A., and Quiney, N.
- Published
- 2015
35. IMPLICATIONS OF SCREENING FOR CYP2B6 516G>T SNP ON HIV/AIDS PATIENTS: 537
- Author
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Swart, M. and Dandara, C.
- Published
- 2014
36. ELPQuiC (Emergency Laparotomy Pathway Quality Improvement Care-bundle): reducing mortality after emergency major general surgery: 4
- Author
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Huddart, S., Peden, C., Swart, M., McCormick, B., Mohammed, M., Quiney, N., and Collaborators, LPQuiC
- Published
- 2014
37. The role of extracellular sulfatase-2 in inflammation
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Swart, M, Troeberg, L, Monaco, C, and Williams, R
- Subjects
Matrix Biology ,Immunology - Abstract
Rheumatoid arthritis (RA) is a chronic inflammatory joint disease whose molecular pathogenesis serves as a useful model for understanding other chronic inflammatory conditions. Activated macrophages are critical for RA pathogenesis, since they promote the inflammation that causes cartilage damage, bone remodelling, pain and irreversible disability. Macrophages are activated by stimuli in their environment, and responses to these stimuli are fine-tuned by their interactions with highly sulfated heparan sulfate (HS) glycosaminoglycans. HS is sulfated in complex patterns, but 6-O-sulfation of HS glucosamine subunits is known to be particularly important for regulating activity of many cytokines, chemokines and growth factors. 6-O-sulfation is hence tightly regulated, and it is the only HS sulfation motif that can be post-synthetically removed by the extracellular sulfatases SULF1 and SULF2. Although extensively studied in cancer and development, the effect of 6-O-sulfation on inflammation and macrophage function is unknown. In this thesis I showed that Sulf2 is mainly expressed by macrophages, monocytes and dendritic cells. Sulf2 is particularly highly expressed by protective resident alveolar macrophages in the lung and resident synovial macrophages in the joint, indicating that Sulf2 is likely to be important for maintaining homeostasis and suppressing inflammation. Moreover, Sulf2 is downregulated by many inflammatory stimuli, suggesting that downregulation of Sulf2 may enable macrophages to convert from a protective phenotype to an activated inflammatory phenotype. Phagocytosis was increased in Sulf2-deficient macrophages, while macrophage polarisation was inhibited. Sulf2-deficient bone marrow chimeras were generated to investigate the role of Sulf2 in immune function during antigen-induced arthritis (AIA) as an example of a chronic inflammatory disease. These Sulf2-deficient mice developed increased knee swelling, which was associated with an increase in pro-arthritic Th17 cells. In conclusion, SULF2 is important for maintaining homeostasis by suppressing macrophage activation, indicating that therapies reducing 6-O sulfation of HS might be effective for the treatment of RA and other chronic inflammatory diseases.
- Published
- 2020
38. NWChem
- Author
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Aprà, E., Bylaska, E. J., de Jong, W. A., Govind, N., Kowalski, K., Straatsma, T. P., Valiev, M., van Dam, H. J.J., Alexeev, Y., Anchell, J., Anisimov, V., Aquino, F. W., Atta-Fynn, R., Autschbach, J., Bauman, N. P., Becca, J. C., Bernholdt, D. E., Bhaskaran-Nair, K., Bogatko, S., Borowski, P., Boschen, J., Brabec, J., Bruner, A., Cauët, E., Chen, Y., Chuev, G. N., Cramer, C. J., Daily, J., Deegan, M. J.O., Dunning, T. H., Dupuis, M., Dyall, K. G., Fann, G. I., Fischer, S. A., Fonari, A., Früchtl, H., Gagliardi, L., Garza, J., Gawande, N., Ghosh, S., Glaesemann, K., Götz, A. W., Hammond, J., Helms, V., Hermes, E. D., Hirao, K., Hirata, S., Jacquelin, M., Jensen, L., Johnson, B. G., Jónsson, H., Kendall, R. A., Klemm, M., Kobayashi, R., Konkov, V., Krishnamoorthy, S., Krishnan, M., Lin, Z., Lins, R. D., Littlefield, R. J., Logsdail, A. J., Lopata, K., Ma, W., Marenich, A. V., Martin Del Campo, J., Mejia-Rodriguez, D., Moore, J. E., Mullin, J. M., Nakajima, T., Nascimento, D. R., Nichols, J. A., Nichols, P. J., Nieplocha, J., Otero-de-la-Roza, A., Palmer, B., Panyala, A., Pirojsirikul, T., Peng, B., Peverati, R., Pittner, J., Pollack, L., Sadayappan, P., Schatz, G. C., Shelton, W. A., Silverstein, D. W., Smith, D. M.A., Soares, T. A., Song, D., Swart, M., Taylor, H. L., Thomas, G. S., Tipparaju, V., Truhlar, D. G., Tsemekhman, K., Van Voorhis, T., Vázquez-Mayagoitia, Verma, P., Villa, O., Vishnu, A., Vogiatzis, K. D., Wang, Dunyou, Weare, J. H., Williamson, M. J., Windus, T. L., Woliński, K., Wong, A. T., Wu, Q., Yang, C., Yu, Q., Zacharias, M., Zhang, Zhiyong, Zhao, Yan, Harrison, R. J., Pacific Northwest National Laboratory, Lawrence Berkeley National Laboratory, Oak Ridge National Laboratory, Brookhaven National Laboratory, Argonne National Laboratory, Intel, University of Texas at Arlington, The State University of New York at Buffalo, Pennsylvania State University, Washington University St. Louis, Maria Curie-Sklodowska University, Iowa State University, Czech Academy of Sciences, University of Tennessee System, Université Libre de Bruxelles, Facebook Inc, Russian Academy of Sciences, University of Minnesota Twin Cities, Jodrell Bank Observatory, University of Washington, Dirac Solutions, Naval Research Laboratory, Georgia Institute of Technology, University of St Andrews, Universidad Autónoma Metropolitana, University of California San Diego, Saarland University, Sandia National Laboratories, RIKEN, University of Illinois at Urbana-Champaign, Multiscale Statistical and Quantum Physics, Australian National University, Florida Institute of Technology, University of Science and Technology of China, Fundação Oswaldo Cruz, Zerene Systems LLC, Cardiff University, Louisiana State University, CAS - Institute of Software, Universidad Nacional Autónoma de México, University of Florida, Los Alamos National Laboratory, University of Oviedo, Prince of Songkla University, University of Utah, Northwestern University, Universal Display Corporation, Universidade Federal de Pernambuco, ICREA, Cray Inc, Massachusetts Institute of Technology, 1QBit, Nvidia, University of Tennessee, Knoxville, Shandong Normal University, University of Cambridge, Advanced Micro Devices, Technische Universität München, Stanford University, Wuhan University of Technology, Stony Brook University, Department of Applied Physics, Aalto-yliopisto, and Aalto University
- Abstract
Specialized computational chemistry packages have permanently reshaped the landscape of chemical and materials science by providing tools to support and guide experimental efforts and for the prediction of atomistic and electronic properties. In this regard, electronic structure packages have played a special role by using first-principle-driven methodologies to model complex chemical and materials processes. Over the past few decades, the rapid development of computing technologies and the tremendous increase in computational power have offered a unique chance to study complex transformations using sophisticated and predictive many-body techniques that describe correlated behavior of electrons in molecular and condensed phase systems at different levels of theory. In enabling these simulations, novel parallel algorithms have been able to take advantage of computational resources to address the polynomial scaling of electronic structure methods. In this paper, we briefly review the NWChem computational chemistry suite, including its history, design principles, parallel tools, current capabilities, outreach, and outlook.
- Published
- 2020
39. A Unified Framework for Understanding Nucleophilicity and Protophilicity in the S(N)2/E2 Competition
- Author
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Vermeeren, P., Hansen, T., Jansen, P.W., Swart, M., Hamlin, T.A., Bickelhaupt, F.M., Vermeeren, P., Hansen, T., Jansen, P.W., Swart, M., Hamlin, T.A., and Bickelhaupt, F.M.
- Abstract
6 november 2020, Contains fulltext : 227020.pdf (publisher's version ) (Open Access)
- Published
- 2020
40. Facilitating recovery of daily functioning in people with a severe mental illness who need longer-term intensive psychiatric services: Results from a cluster randomized controlled trial on Cognitive Adaptation Training delivered by nurses
- Author
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Stiekema, A. P. M., van Dam, M. T., Bruggeman, R., Redmeijer, J. E., Swart, M., Dethmers, M., Rietberg, K., Wekking, E. M., Velligan, D.I., Timmerman, M. E., Aleman, A., Castelein, S., van Weeghel, J., Pijnenborg, M., van der Meer, L., Stiekema, A. P. M., van Dam, M. T., Bruggeman, R., Redmeijer, J. E., Swart, M., Dethmers, M., Rietberg, K., Wekking, E. M., Velligan, D.I., Timmerman, M. E., Aleman, A., Castelein, S., van Weeghel, J., Pijnenborg, M., and van der Meer, L.
- Abstract
Background: Feasible and effective interventions to improve daily functioning in people with a severe mental illness (SMI), such as schizophrenia, in need of longer-term rehabilitation are scarce. Aims: We assessed the effectiveness of Cognitive Adaptation Training (CAT), a compensatory intervention to improve daily functioning, modified into a nursing intervention. Method: In this cluster randomized controlled trial, 12 nursing teams were randomized to CAT in addition to treatment as usual (CAT; n = 42) or TAU (n = 47). Daily functioning (primary outcome) was assessed every 3 months for 1 year. Additional follow-up assessments were performed for the CAT group in the second year. Secondary outcomes were assessed every 6 months. Data were analyzed using multilevel modeling. Results: CAT participants improved significantly on daily functioning, executive functioning, and visual attention after 12 months compared to TAU. Improvements were maintained after 24 months. Improved executive functioning was related to improved daily functioning. Other secondary outcomes (quality of life, empowerment, negative symptoms) showed no significant effects. Conclusions: As a nursing intervention, CAT leads to maintained improvements in daily functioning, and may improve executive functioning and visual attention in people with SMI in need of longer-term intensive psychiatric care. Given the paucity of evidence-based interventions in this population, CAT can become a valuable addition to recovery-oriented care.
- Published
- 2020
41. Patient outcomes following an endometrial thermal balloon ablation (thermochoice) procedure for menorrhagia in a day surgery unit
- Author
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Barrington, J. W., Bano, F., Swart, M., and Montgomery, J.
- Published
- 2004
- Full Text
- View/download PDF
42. Effective Communication N6
- Author
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Swart M, Hairbottle M, Scheün R and Swart M, Hairbottle M, Scheün R
- Subjects
- Communication in management, Business communication
- Abstract
In the age of digital transformation, effective communication strategies and means in the workplace are essential. Great communicators are the ones who bring solutions, drive change, and motivate and inspire their colleagues. By improving communication skills, it is possible to enhance employee engagement, teamwork, decision-making and interdepartmental communication. People who are good and empowered communicators are also great ambassadors for their place of work. For these reasons, communication skills are the soft skills that employers seek the most in their employees. Effective Communication N6 – empowering the workforce aims to help develop a solid strategy to keep employees informed and engaged; to avoid communication silos and overload; to build interpersonal relations, and to encourage a productive and conducive work environment. Tips are provided on how to promote an open organisational culture of trust and satisfaction, where knowledge sharing and healthy relations are prevalent and the use of various media is facilitated. There are ample timely, concrete and real-life exercises and applications, and examples and illustrations of communication in action. Effective Communication N6 – empowering the workforce is designed to take workplace communication to the next level and can be used by students, employees and those at executive management level.
- Published
- 2022
43. Accuracy of geometries: influence of basis set, exchange–correlation potential, inclusion of core electrons, and relativistic corrections
- Author
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Swart, M. and Snijders, J. G.
- Published
- 2003
- Full Text
- View/download PDF
44. Pharmacokinetics of S-1, an oral formulation of ftorafur, oxonic acid and 5-chloro-2,4-dihydroxypyridine (molar ratio 1:0.4:1) in patients with solid tumors
- Author
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Peters, G. J., Noordhuis, P., Van Kuilenburg, A. B. P., Schornagel, J. H., Gall, H., Turner, S. L., Swart, M. S., Voorn, D., Van Gennip, A. H., Wanders, J., Holwerda, U., Smid, K., Giaccone, G., Fumoleau, P., and Van Groeningen, C. J.
- Published
- 2003
- Full Text
- View/download PDF
45. Evaluation of the bioequivalence of tablets and capsules containing the novel anticancer agent R115777 (Zarnestra) in patients with advanced solid tumors
- Author
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Crul, M., De Klerk, G. J., Swart, M., Weiner, L., Palmer, P. A., Bol, C. J., Beijnen, J. H., and Schellens, J. H. M.
- Published
- 2002
- Full Text
- View/download PDF
46. Safety of day‐case paediatric tonsillectomy in England: an analysis of administrative data for the Getting It Right First Time programme.
- Author
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Gray, W. K., Takhar, A. S., Navaratnam, A. V., Day, J., Swart, M., Snowden, C., Briggs, T. W. R., and Marshall, A.
- Subjects
TONSILLECTOMY ,TONSILLITIS ,PEDIATRICS ,DATA analysis ,NUMERIC databases ,HOSPITAL statistics ,TREATMENT effectiveness - Abstract
Summary: We used the Hospital Episodes Statistics database to investigate unwarranted variation in the rates Trusts discharged children the same day after scheduled tonsillectomy and associations with adverse postoperative outcomes. We included children aged 2–18 years who underwent tonsillectomy between 1 April 2014 and 31 March 2019. We stratified analyses by category of Trust, non‐specialist or specialist, defined as without or with paediatric critical care facilities, respectively. We adjusted analyses for age, sex, year of surgery and aspects of presentation and procedure type. Of 101,180 children who underwent tonsillectomy at non‐specialist Trusts, 62,926 (62%) were discharged the same day, compared with 24,138/48,755 (50%) at specialist Trusts. The adjusted proportion of children discharged the same day as tonsillectomy ranged from 5% to 100% at non‐specialist Trusts and 9% to 88% at specialist Trusts. Same‐day discharge was not independently associated with an increased rate of 30‐day emergency re‐admission at non‐specialist Trusts but was associated with a modest rate increase at specialist Trusts; adjusted probability 8.0% vs 7.7%, odds ratio (95%CI) 1.14 (1.05–1.24). Rates of adverse postoperative outcomes were similar for Trusts that discharged >70% children the same day as tonsillectomy compared with Trusts that discharged <50% children the same day, for both non‐specialist and specialist Trust categories. We found no consistent evidence that day‐case tonsillectomy is associated with poorer outcomes. All Trusts, but particularly specialist centres, should explore reasons for low day‐case rates and should aim for rates >70%. [ABSTRACT FROM AUTHOR]
- Published
- 2022
- Full Text
- View/download PDF
47. Successful treatment with paclitaxel of a patient with metastatic extra-adrenal pheochromocytoma (paraganglioma): A case report and review of the literature
- Author
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Kruijtzer, C. M. F., Beijnen, J. H., Swart, M., and Schellens, J. H. M.
- Published
- 2000
- Full Text
- View/download PDF
48. Authorsʼ reply: case-controlled study of critical care or surgical ward care after elective open colorectal surgery (Br J Surg 2012 99 295–299)
- Author
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Swart, M. and Carlisle, J.
- Published
- 2012
- Full Text
- View/download PDF
49. Factors associated with survival after resection of colorectal adenocarcinoma in 314 patients
- Author
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Carlisle, J., Swart, M., Dawe, E. J. C., and Chadwick, M.
- Published
- 2012
- Full Text
- View/download PDF
50. Case–controlled study of critical care or surgical ward care after elective open colorectal surgery
- Author
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Swart, M. and Carlisle, J. B.
- Published
- 2012
- Full Text
- View/download PDF
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