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Programmatic conversion of crystal structures into 3D printable files using Jmol

Vincent F. Scalfani, Antony J. Williams, Valery Tkachenko, Karen Karapetyan, Alexey Pshenichnov, Robert M. Hanson, Jahred M. Liddie, Jason E. Bara
<span title="2016-11-23">2016</span> <i title="Springer Nature"> <a target="_blank" rel="noopener" href="https://fatcat.wiki/container/5aubiwi6v5beng6iqzj577kiaa" style="color: black;">Journal of Cheminformatics</a> </i> &nbsp;
To overcome this limitation, we developed a programmatic method that allows for facile conversion of thousands of crystal structures directly into 3D printable files.  ...  large database collections of crystal structures into 3D printable files.  ...  Acknowledgements VFS thanks The University of Alabama Libraries for support of this work and Ms. Rosanne Rumstay for her assistance with 3D printing.  ... 
<span class="external-identifiers"> <a target="_blank" rel="external noopener noreferrer" href="https://doi.org/10.1186/s13321-016-0181-z">doi:10.1186/s13321-016-0181-z</a> <a target="_blank" rel="external noopener" href="https://www.ncbi.nlm.nih.gov/pubmed/27933103">pmid:27933103</a> <a target="_blank" rel="external noopener" href="https://pubmed.ncbi.nlm.nih.gov/PMC5122160/">pmcid:PMC5122160</a> <a target="_blank" rel="external noopener" href="https://fatcat.wiki/release/337gkomo2vgjzb7sc2l3ej4tnu">fatcat:337gkomo2vgjzb7sc2l3ej4tnu</a> </span>
<a target="_blank" rel="noopener" href="https://web.archive.org/web/20170921203635/https://jcheminf.springeropen.com/track/pdf/10.1186/s13321-016-0181-z?site=jcheminf.springeropen.com" title="fulltext PDF download" data-goatcounter-click="serp-fulltext" data-goatcounter-title="serp-fulltext"> <button class="ui simple right pointing dropdown compact black labeled icon button serp-button"> <i class="icon ia-icon"></i> Web Archive [PDF] <div class="menu fulltext-thumbnail"> <img src="https://blobs.fatcat.wiki/thumbnail/pdf/65/f5/65f5bc9ed665b05f1014334a403db96d8db5caff.180px.jpg" alt="fulltext thumbnail" loading="lazy"> </div> </button> </a> <a target="_blank" rel="external noopener noreferrer" href="https://doi.org/10.1186/s13321-016-0181-z"> <button class="ui left aligned compact blue labeled icon button serp-button"> <i class="unlock alternate icon" style="background-color: #fb971f;"></i> springer.com </button> </a> <a target="_blank" rel="external noopener" href="https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5122160" title="pubmed link"> <button class="ui compact blue labeled icon button serp-button"> <i class="file alternate outline icon"></i> pubmed.gov </button> </a>

One-click preparation of 3D print files (*.stl, *.wrl) from *.cif (crystallographic information framework) data using Cif2VRML

Werner Kaminsky, Trevor Snyder, Jennifer Stone-Sundberg, Peter Moeck
<span title="">2014</span> <i title="Cambridge University Press (CUP)"> <a target="_blank" rel="noopener" href="https://fatcat.wiki/container/zsxthlss3zhw5cb4u4y3qjgr7m" style="color: black;">Powder Diffraction</a> </i> &nbsp;
Recommendations are made on the basis of our preliminary printing efforts. A brief outlook on new materials for 3D printing is given.  ...  Ongoing software developments for creating three-dimensional (3D) printed crystallographic models seamlessly from Crystallographic Information Framework (CIF) data (*.cif files) are reported.  ...  to loading the structure's *.cif file into a single Windows application, Cif2VRML, followed by saving the 3D printable file involving only one mouse "click".  ... 
<span class="external-identifiers"> <a target="_blank" rel="external noopener noreferrer" href="https://doi.org/10.1017/s0885715614001092">doi:10.1017/s0885715614001092</a> <a target="_blank" rel="external noopener" href="https://fatcat.wiki/release/uqxbrhq6c5cdti6efkwul7ursa">fatcat:uqxbrhq6c5cdti6efkwul7ursa</a> </span>
<a target="_blank" rel="noopener" href="https://web.archive.org/web/20190503041639/https://www.cambridge.org/core/services/aop-cambridge-core/content/view/C299EEF1AD098281845B01AC221399E2/S0885715614001092a.pdf/div-class-title-one-click-preparation-of-3d-print-files-stl-wrl-from-cif-crystallographic-information-framework-data-using-cif2vrml-div.pdf" title="fulltext PDF download" data-goatcounter-click="serp-fulltext" data-goatcounter-title="serp-fulltext"> <button class="ui simple right pointing dropdown compact black labeled icon button serp-button"> <i class="icon ia-icon"></i> Web Archive [PDF] <div class="menu fulltext-thumbnail"> <img src="https://blobs.fatcat.wiki/thumbnail/pdf/da/54/da5478cd13828b4b8eef0903741d41cd8e0ca2c5.180px.jpg" alt="fulltext thumbnail" loading="lazy"> </div> </button> </a> <a target="_blank" rel="external noopener noreferrer" href="https://doi.org/10.1017/s0885715614001092"> <button class="ui left aligned compact blue labeled icon button serp-button"> <i class="external alternate icon"></i> cambridge.org </button> </a>

3D printing in the context of Science, Technology, Engineering, and Mathematics education at the college/university level [article]

Peter Moeck, Paul DeStefano, Werner Kaminsky, Trevor Snyder
<span title="2019-11-07">2019</span> <i > arXiv </i> &nbsp; <span class="release-stage" >pre-print</span>
A straightforward route from crystallographic information framework files (CIFs) at a very large open-access database to 3D print files for atomic-level crystal and molecule structure models is described  ...  The vast majority of quoted papers report self-made models for which faculty members and their students have created the necessary 3D print files themselves by various routes.  ...  Olaf College, Northfield/Minnesota, is thanked for both his great work over many years in connection with the development of Jmol/JSmol and his generosity as demonstrated by him making the results of these  ... 
<span class="external-identifiers"> <a target="_blank" rel="external noopener" href="https://arxiv.org/abs/2001.04267v1">arXiv:2001.04267v1</a> <a target="_blank" rel="external noopener" href="https://fatcat.wiki/release/bb6irvtnlvdzbemfsog27lb3ja">fatcat:bb6irvtnlvdzbemfsog27lb3ja</a> </span>
<a target="_blank" rel="noopener" href="https://web.archive.org/web/20200321075613/https://arxiv.org/pdf/2001.04267v1.pdf" title="fulltext PDF download" data-goatcounter-click="serp-fulltext" data-goatcounter-title="serp-fulltext"> <button class="ui simple right pointing dropdown compact black labeled icon button serp-button"> <i class="icon ia-icon"></i> Web Archive [PDF] </button> </a> <a target="_blank" rel="external noopener" href="https://arxiv.org/abs/2001.04267v1" title="arxiv.org access"> <button class="ui compact blue labeled icon button serp-button"> <i class="file alternate outline icon"></i> arxiv.org </button> </a>

A systematic review of 3D printing in chemistry education – analysis of earlier research and educational use through technological pedagogical content knowledge framework

Johannes Pernaa, Susanne Wiedmer
<span title="2019-09-17">2019</span> <i title="Walter de Gruyter GmbH"> <a target="_blank" rel="noopener" href="https://fatcat.wiki/container/e3tvwb7firdzllv7m6od4chvoi" style="color: black;">Chemistry Teacher International</a> </i> &nbsp;
; what kind of design strategies have been implemented; how 3D printing has been used in chemistry education research.  ...  There is a great need for comprehensive student-centred pedagogical models for the use of 3D printing in chemistry education.  ...  Scalfani et al. (2016) introduced a Jmol script that enables conversion of crystal structures into 3D printable files.  ... 
<span class="external-identifiers"> <a target="_blank" rel="external noopener noreferrer" href="https://doi.org/10.1515/cti-2019-0005">doi:10.1515/cti-2019-0005</a> <a target="_blank" rel="external noopener" href="https://fatcat.wiki/release/qltywav2ffebrodpl7fdvfvidy">fatcat:qltywav2ffebrodpl7fdvfvidy</a> </span>
<a target="_blank" rel="noopener" href="https://web.archive.org/web/20200509064552/https://www.degruyter.com/downloadpdf/journals/cti/ahead-of-print/article-10.1515-cti-2019-0005/article-10.1515-cti-2019-0005.pdf" title="fulltext PDF download" data-goatcounter-click="serp-fulltext" data-goatcounter-title="serp-fulltext"> <button class="ui simple right pointing dropdown compact black labeled icon button serp-button"> <i class="icon ia-icon"></i> Web Archive [PDF] <div class="menu fulltext-thumbnail"> <img src="https://blobs.fatcat.wiki/thumbnail/pdf/66/62/6662f6b814c19b933502440afcea2e3e05e0cd40.180px.jpg" alt="fulltext thumbnail" loading="lazy"> </div> </button> </a> <a target="_blank" rel="external noopener noreferrer" href="https://doi.org/10.1515/cti-2019-0005"> <button class="ui left aligned compact blue labeled icon button serp-button"> <i class="unlock alternate icon" style="background-color: #fb971f;"></i> degruyter.com </button> </a>