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Phaser crystallographic software.
McCoy AJ, Grosse-Kunstleve RW, Adams PD, Winn MD, Storoni LC, Read RJ. McCoy AJ, et al. J Appl Crystallogr. 2007 Aug 1;40(Pt 4):658-674. doi: 10.1107/S0021889807021206. Epub 2007 Jul 13. J Appl Crystallogr. 2007. PMID: 19461840 Free PMC article.
phenix.model_vs_data: a high-level tool for the calculation of crystallographic model and data statistics.
Afonine PV, Grosse-Kunstleve RW, Chen VB, Headd JJ, Moriarty NW, Richardson JS, Richardson DC, Urzhumtsev A, Zwart PH, Adams PD. Afonine PV, et al. J Appl Crystallogr. 2010 Aug 1;43(Pt 4):669-676. doi: 10.1107/S0021889810015608. Epub 2010 May 22. J Appl Crystallogr. 2010. PMID: 20648263 Free PMC article.
iotbx.cif: a comprehensive CIF toolbox.
Gildea RJ, Bourhis LJ, Dolomanov OV, Grosse-Kunstleve RW, Puschmann H, Adams PD, Howard JA. Gildea RJ, et al. J Appl Crystallogr. 2011 Dec 1;44(Pt 6):1259-1263. doi: 10.1107/S0021889811041161. Epub 2011 Oct 29. J Appl Crystallogr. 2011. PMID: 22199401 Free PMC article.
PHENIX: building new software for automated crystallographic structure determination.
Adams PD, Grosse-Kunstleve RW, Hung LW, Ioerger TR, McCoy AJ, Moriarty NW, Read RJ, Sacchettini JC, Sauter NK, Terwilliger TC. Adams PD, et al. Acta Crystallogr D Biol Crystallogr. 2002 Nov;58(Pt 11):1948-54. doi: 10.1107/s0907444902016657. Epub 2002 Oct 21. Acta Crystallogr D Biol Crystallogr. 2002. PMID: 12393927
DiSCaMB: a software library for aspherical atom model X-ray scattering factor calculations with CPUs and GPUs.
Chodkiewicz ML, Migacz S, Rudnicki W, Makal A, Kalinowski JA, Moriarty NW, Grosse-Kunstleve RW, Afonine PV, Adams PD, Dominiak PM. Chodkiewicz ML, et al. Among authors: grosse kunstleve rw. J Appl Crystallogr. 2018 Feb 1;51(Pt 1):193-199. doi: 10.1107/S1600576717015825. eCollection 2018 Feb 1. J Appl Crystallogr. 2018. PMID: 29507550 Free PMC article.
Automatic multiple-zone rigid-body refinement with a large convergence radius.
Afonine PV, Grosse-Kunstleve RW, Urzhumtsev A, Adams PD. Afonine PV, et al. J Appl Crystallogr. 2009 Aug 1;42(Pt 4):607-615. doi: 10.1107/S0021889809023528. Epub 2009 Jul 16. J Appl Crystallogr. 2009. PMID: 19649324 Free PMC article.
Robust indexing for automatic data collection.
Sauter NK, Grosse-Kunstleve RW, Adams PD. Sauter NK, et al. J Appl Crystallogr. 2004 Jun 1;37(Pt 3):399-409. doi: 10.1107/S0021889804005874. Epub 2004 May 11. J Appl Crystallogr. 2004. PMID: 20090869 Free PMC article.
Graphical tools for macromolecular crystallography in PHENIX.
Echols N, Grosse-Kunstleve RW, Afonine PV, Bunkóczi G, Chen VB, Headd JJ, McCoy AJ, Moriarty NW, Read RJ, Richardson DC, Richardson JS, Terwilliger TC, Adams PD. Echols N, et al. Among authors: grosse kunstleve rw. J Appl Crystallogr. 2012 Jun 1;45(Pt 3):581-586. doi: 10.1107/S0021889812017293. Epub 2012 May 16. J Appl Crystallogr. 2012. PMID: 22675231 Free PMC article.
Algorithms for deriving crystallographic space-group information.
Grosse-Kunstleve RW. Grosse-Kunstleve RW. Acta Crystallogr A. 1999 Mar 1;55(Pt 2 Pt 2):383-395. doi: 10.1107/s0108767398010186. Acta Crystallogr A. 1999. PMID: 10927267
Crystallography & NMR system: A new software suite for macromolecular structure determination.
Brünger AT, Adams PD, Clore GM, DeLano WL, Gros P, Grosse-Kunstleve RW, Jiang JS, Kuszewski J, Nilges M, Pannu NS, Read RJ, Rice LM, Simonson T, Warren GL. Brünger AT, et al. Acta Crystallogr D Biol Crystallogr. 1998 Sep 1;54(Pt 5):905-21. doi: 10.1107/s0907444998003254. Acta Crystallogr D Biol Crystallogr. 1998. PMID: 9757107
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