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The CCP4 suite: integrative software for macromolecular crystallography

The Collaborative Computational Project No. 4 (CCP4) is a UK-led international collective with a mission to develop, test, distribute and promote software for macromolecular crystallography. The CCP4 suite is a multiplatform collection of programs brought together by familiar execution routines, a s...

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Autores principales: Agirre, Jon, Atanasova, Mihaela, Bagdonas, Haroldas, Ballard, Charles B., Baslé, Arnaud, Beilsten-Edmands, James, Borges, Rafael J., Brown, David G., Burgos-Mármol, J. Javier, Berrisford, John M., Bond, Paul S., Caballero, Iracema, Catapano, Lucrezia, Chojnowski, Grzegorz, Cook, Atlanta G., Cowtan, Kevin D., Croll, Tristan I., Debreczeni, Judit É., Devenish, Nicholas E., Dodson, Eleanor J., Drevon, Tarik R., Emsley, Paul, Evans, Gwyndaf, Evans, Phil R., Fando, Maria, Foadi, James, Fuentes-Montero, Luis, Garman, Elspeth F., Gerstel, Markus, Gildea, Richard J., Hatti, Kaushik, Hekkelman, Maarten L., Heuser, Philipp, Hoh, Soon Wen, Hough, Michael A., Jenkins, Huw T., Jiménez, Elisabet, Joosten, Robbie P., Keegan, Ronan M., Keep, Nicholas, Krissinel, Eugene B., Kolenko, Petr, Kovalevskiy, Oleg, Lamzin, Victor S., Lawson, David M., Lebedev, Andrey A., Leslie, Andrew G. W., Lohkamp, Bernhard, Long, Fei, Malý, Martin, McCoy, Airlie J., McNicholas, Stuart J., Medina, Ana, Millán, Claudia, Murray, James W., Murshudov, Garib N., Nicholls, Robert A., Noble, Martin E. M., Oeffner, Robert, Pannu, Navraj S., Parkhurst, James M., Pearce, Nicholas, Pereira, Joana, Perrakis, Anastassis, Powell, Harold R., Read, Randy J., Rigden, Daniel J., Rochira, William, Sammito, Massimo, Sánchez Rodríguez, Filomeno, Sheldrick, George M., Shelley, Kathryn L., Simkovic, Felix, Simpkin, Adam J., Skubak, Pavol, Sobolev, Egor, Steiner, Roberto A., Stevenson, Kyle, Tews, Ivo, Thomas, Jens M. H., Thorn, Andrea, Valls, Josep Triviño, Uski, Ville, Usón, Isabel, Vagin, Alexei, Velankar, Sameer, Vollmar, Melanie, Walden, Helen, Waterman, David, Wilson, Keith S., Winn, Martyn D., Winter, Graeme, Wojdyr, Marcin, Yamashita, Keitaro
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10233625/
https://www.ncbi.nlm.nih.gov/pubmed/37259835
http://dx.doi.org/10.1107/S2059798323003595
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author Agirre, Jon
Atanasova, Mihaela
Bagdonas, Haroldas
Ballard, Charles B.
Baslé, Arnaud
Beilsten-Edmands, James
Borges, Rafael J.
Brown, David G.
Burgos-Mármol, J. Javier
Berrisford, John M.
Bond, Paul S.
Caballero, Iracema
Catapano, Lucrezia
Chojnowski, Grzegorz
Cook, Atlanta G.
Cowtan, Kevin D.
Croll, Tristan I.
Debreczeni, Judit É.
Devenish, Nicholas E.
Dodson, Eleanor J.
Drevon, Tarik R.
Emsley, Paul
Evans, Gwyndaf
Evans, Phil R.
Fando, Maria
Foadi, James
Fuentes-Montero, Luis
Garman, Elspeth F.
Gerstel, Markus
Gildea, Richard J.
Hatti, Kaushik
Hekkelman, Maarten L.
Heuser, Philipp
Hoh, Soon Wen
Hough, Michael A.
Jenkins, Huw T.
Jiménez, Elisabet
Joosten, Robbie P.
Keegan, Ronan M.
Keep, Nicholas
Krissinel, Eugene B.
Kolenko, Petr
Kovalevskiy, Oleg
Lamzin, Victor S.
Lawson, David M.
Lebedev, Andrey A.
Leslie, Andrew G. W.
Lohkamp, Bernhard
Long, Fei
Malý, Martin
McCoy, Airlie J.
McNicholas, Stuart J.
Medina, Ana
Millán, Claudia
Murray, James W.
Murshudov, Garib N.
Nicholls, Robert A.
Noble, Martin E. M.
Oeffner, Robert
Pannu, Navraj S.
Parkhurst, James M.
Pearce, Nicholas
Pereira, Joana
Perrakis, Anastassis
Powell, Harold R.
Read, Randy J.
Rigden, Daniel J.
Rochira, William
Sammito, Massimo
Sánchez Rodríguez, Filomeno
Sheldrick, George M.
Shelley, Kathryn L.
Simkovic, Felix
Simpkin, Adam J.
Skubak, Pavol
Sobolev, Egor
Steiner, Roberto A.
Stevenson, Kyle
Tews, Ivo
Thomas, Jens M. H.
Thorn, Andrea
Valls, Josep Triviño
Uski, Ville
Usón, Isabel
Vagin, Alexei
Velankar, Sameer
Vollmar, Melanie
Walden, Helen
Waterman, David
Wilson, Keith S.
Winn, Martyn D.
Winter, Graeme
Wojdyr, Marcin
Yamashita, Keitaro
author_facet Agirre, Jon
Atanasova, Mihaela
Bagdonas, Haroldas
Ballard, Charles B.
Baslé, Arnaud
Beilsten-Edmands, James
Borges, Rafael J.
Brown, David G.
Burgos-Mármol, J. Javier
Berrisford, John M.
Bond, Paul S.
Caballero, Iracema
Catapano, Lucrezia
Chojnowski, Grzegorz
Cook, Atlanta G.
Cowtan, Kevin D.
Croll, Tristan I.
Debreczeni, Judit É.
Devenish, Nicholas E.
Dodson, Eleanor J.
Drevon, Tarik R.
Emsley, Paul
Evans, Gwyndaf
Evans, Phil R.
Fando, Maria
Foadi, James
Fuentes-Montero, Luis
Garman, Elspeth F.
Gerstel, Markus
Gildea, Richard J.
Hatti, Kaushik
Hekkelman, Maarten L.
Heuser, Philipp
Hoh, Soon Wen
Hough, Michael A.
Jenkins, Huw T.
Jiménez, Elisabet
Joosten, Robbie P.
Keegan, Ronan M.
Keep, Nicholas
Krissinel, Eugene B.
Kolenko, Petr
Kovalevskiy, Oleg
Lamzin, Victor S.
Lawson, David M.
Lebedev, Andrey A.
Leslie, Andrew G. W.
Lohkamp, Bernhard
Long, Fei
Malý, Martin
McCoy, Airlie J.
McNicholas, Stuart J.
Medina, Ana
Millán, Claudia
Murray, James W.
Murshudov, Garib N.
Nicholls, Robert A.
Noble, Martin E. M.
Oeffner, Robert
Pannu, Navraj S.
Parkhurst, James M.
Pearce, Nicholas
Pereira, Joana
Perrakis, Anastassis
Powell, Harold R.
Read, Randy J.
Rigden, Daniel J.
Rochira, William
Sammito, Massimo
Sánchez Rodríguez, Filomeno
Sheldrick, George M.
Shelley, Kathryn L.
Simkovic, Felix
Simpkin, Adam J.
Skubak, Pavol
Sobolev, Egor
Steiner, Roberto A.
Stevenson, Kyle
Tews, Ivo
Thomas, Jens M. H.
Thorn, Andrea
Valls, Josep Triviño
Uski, Ville
Usón, Isabel
Vagin, Alexei
Velankar, Sameer
Vollmar, Melanie
Walden, Helen
Waterman, David
Wilson, Keith S.
Winn, Martyn D.
Winter, Graeme
Wojdyr, Marcin
Yamashita, Keitaro
author_sort Agirre, Jon
collection PubMed
description The Collaborative Computational Project No. 4 (CCP4) is a UK-led international collective with a mission to develop, test, distribute and promote software for macromolecular crystallography. The CCP4 suite is a multiplatform collection of programs brought together by familiar execution routines, a set of common libraries and graphical interfaces. The CCP4 suite has experienced several considerable changes since its last reference article, involving new infrastructure, original programs and graphical interfaces. This article, which is intended as a general literature citation for the use of the CCP4 software suite in structure determination, will guide the reader through such transformations, offering a general overview of the new features and outlining future developments. As such, it aims to highlight the individual programs that comprise the suite and to provide the latest references to them for perusal by crystallographers around the world.
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spelling pubmed-102336252023-06-02 The CCP4 suite: integrative software for macromolecular crystallography Agirre, Jon Atanasova, Mihaela Bagdonas, Haroldas Ballard, Charles B. Baslé, Arnaud Beilsten-Edmands, James Borges, Rafael J. Brown, David G. Burgos-Mármol, J. Javier Berrisford, John M. Bond, Paul S. Caballero, Iracema Catapano, Lucrezia Chojnowski, Grzegorz Cook, Atlanta G. Cowtan, Kevin D. Croll, Tristan I. Debreczeni, Judit É. Devenish, Nicholas E. Dodson, Eleanor J. Drevon, Tarik R. Emsley, Paul Evans, Gwyndaf Evans, Phil R. Fando, Maria Foadi, James Fuentes-Montero, Luis Garman, Elspeth F. Gerstel, Markus Gildea, Richard J. Hatti, Kaushik Hekkelman, Maarten L. Heuser, Philipp Hoh, Soon Wen Hough, Michael A. Jenkins, Huw T. Jiménez, Elisabet Joosten, Robbie P. Keegan, Ronan M. Keep, Nicholas Krissinel, Eugene B. Kolenko, Petr Kovalevskiy, Oleg Lamzin, Victor S. Lawson, David M. Lebedev, Andrey A. Leslie, Andrew G. W. Lohkamp, Bernhard Long, Fei Malý, Martin McCoy, Airlie J. McNicholas, Stuart J. Medina, Ana Millán, Claudia Murray, James W. Murshudov, Garib N. Nicholls, Robert A. Noble, Martin E. M. Oeffner, Robert Pannu, Navraj S. Parkhurst, James M. Pearce, Nicholas Pereira, Joana Perrakis, Anastassis Powell, Harold R. Read, Randy J. Rigden, Daniel J. Rochira, William Sammito, Massimo Sánchez Rodríguez, Filomeno Sheldrick, George M. Shelley, Kathryn L. Simkovic, Felix Simpkin, Adam J. Skubak, Pavol Sobolev, Egor Steiner, Roberto A. Stevenson, Kyle Tews, Ivo Thomas, Jens M. H. Thorn, Andrea Valls, Josep Triviño Uski, Ville Usón, Isabel Vagin, Alexei Velankar, Sameer Vollmar, Melanie Walden, Helen Waterman, David Wilson, Keith S. Winn, Martyn D. Winter, Graeme Wojdyr, Marcin Yamashita, Keitaro Acta Crystallogr D Struct Biol Ccp4 The Collaborative Computational Project No. 4 (CCP4) is a UK-led international collective with a mission to develop, test, distribute and promote software for macromolecular crystallography. The CCP4 suite is a multiplatform collection of programs brought together by familiar execution routines, a set of common libraries and graphical interfaces. The CCP4 suite has experienced several considerable changes since its last reference article, involving new infrastructure, original programs and graphical interfaces. This article, which is intended as a general literature citation for the use of the CCP4 software suite in structure determination, will guide the reader through such transformations, offering a general overview of the new features and outlining future developments. As such, it aims to highlight the individual programs that comprise the suite and to provide the latest references to them for perusal by crystallographers around the world. International Union of Crystallography 2023-05-30 /pmc/articles/PMC10233625/ /pubmed/37259835 http://dx.doi.org/10.1107/S2059798323003595 Text en © Jon Agirre et al. 2023 https://creativecommons.org/licenses/by/4.0/This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Ccp4
Agirre, Jon
Atanasova, Mihaela
Bagdonas, Haroldas
Ballard, Charles B.
Baslé, Arnaud
Beilsten-Edmands, James
Borges, Rafael J.
Brown, David G.
Burgos-Mármol, J. Javier
Berrisford, John M.
Bond, Paul S.
Caballero, Iracema
Catapano, Lucrezia
Chojnowski, Grzegorz
Cook, Atlanta G.
Cowtan, Kevin D.
Croll, Tristan I.
Debreczeni, Judit É.
Devenish, Nicholas E.
Dodson, Eleanor J.
Drevon, Tarik R.
Emsley, Paul
Evans, Gwyndaf
Evans, Phil R.
Fando, Maria
Foadi, James
Fuentes-Montero, Luis
Garman, Elspeth F.
Gerstel, Markus
Gildea, Richard J.
Hatti, Kaushik
Hekkelman, Maarten L.
Heuser, Philipp
Hoh, Soon Wen
Hough, Michael A.
Jenkins, Huw T.
Jiménez, Elisabet
Joosten, Robbie P.
Keegan, Ronan M.
Keep, Nicholas
Krissinel, Eugene B.
Kolenko, Petr
Kovalevskiy, Oleg
Lamzin, Victor S.
Lawson, David M.
Lebedev, Andrey A.
Leslie, Andrew G. W.
Lohkamp, Bernhard
Long, Fei
Malý, Martin
McCoy, Airlie J.
McNicholas, Stuart J.
Medina, Ana
Millán, Claudia
Murray, James W.
Murshudov, Garib N.
Nicholls, Robert A.
Noble, Martin E. M.
Oeffner, Robert
Pannu, Navraj S.
Parkhurst, James M.
Pearce, Nicholas
Pereira, Joana
Perrakis, Anastassis
Powell, Harold R.
Read, Randy J.
Rigden, Daniel J.
Rochira, William
Sammito, Massimo
Sánchez Rodríguez, Filomeno
Sheldrick, George M.
Shelley, Kathryn L.
Simkovic, Felix
Simpkin, Adam J.
Skubak, Pavol
Sobolev, Egor
Steiner, Roberto A.
Stevenson, Kyle
Tews, Ivo
Thomas, Jens M. H.
Thorn, Andrea
Valls, Josep Triviño
Uski, Ville
Usón, Isabel
Vagin, Alexei
Velankar, Sameer
Vollmar, Melanie
Walden, Helen
Waterman, David
Wilson, Keith S.
Winn, Martyn D.
Winter, Graeme
Wojdyr, Marcin
Yamashita, Keitaro
The CCP4 suite: integrative software for macromolecular crystallography
title The CCP4 suite: integrative software for macromolecular crystallography
title_full The CCP4 suite: integrative software for macromolecular crystallography
title_fullStr The CCP4 suite: integrative software for macromolecular crystallography
title_full_unstemmed The CCP4 suite: integrative software for macromolecular crystallography
title_short The CCP4 suite: integrative software for macromolecular crystallography
title_sort ccp4 suite: integrative software for macromolecular crystallography
topic Ccp4
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10233625/
https://www.ncbi.nlm.nih.gov/pubmed/37259835
http://dx.doi.org/10.1107/S2059798323003595
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