Center for Molecular Modeling - S. Van Damme https://molmod.ugent.be/publication-authors/s-van-damme en Conformational analysis of evolutionairy conserved terpene-ring systems in a search for new privileged scaffolds https://molmod.ugent.be/thesis/conformational-analysis-evolutionairy-conserved-terpene-ring-systems-search-new-privileged <div class="field field-name-field-a1-authors field-type-taxonomy-term-reference field-label-hidden"> <span class="field-items"> A. Luttens </span> </div> <div class="field field-name-field-courses field-type-list-text field-label-hidden"> <div class="field-items"> <div class="field-item even">Master of Science in Chemistry</div> </div> </div> <div class="field field-name-field-master-year field-type-date field-label-hidden"> <div class="field-items"> <div class="field-item even"><span class="date-display-single" property="dc:date" datatype="xsd:dateTime" content="2017-01-01T00:00:00+01:00">2017</span></div> </div> </div> <div class="field field-name-field-promotoren field-type-taxonomy-term-reference field-label-inline clearfix"> <h3 class="field-label">Supervisors</h3> <span class="field-items"> <a href="/promotors/prof-dr-j-winne" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">Prof. Dr. J. Winne</a>, <a href="/promotors/prof-dr-ir-toon-verstraelen" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">Prof. Dr. ir. Toon Verstraelen</a>, <a href="/promotors/prof-dr-s-van-damme" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">Prof. Dr. S. Van Damme</a> </span> </div> Thu, 15 Sep 2016 11:42:09 +0000 wim 4436 at https://molmod.ugent.be https://molmod.ugent.be/thesis/conformational-analysis-evolutionairy-conserved-terpene-ring-systems-search-new-privileged#comments Hirshfeld-I charges: from molecules to solids: implementation, pitfalls and applications https://molmod.ugent.be/c1_c3_publications/hirshfeld-i-charges-molecules-solids-implementation-pitfalls-and-applications <div class="field field-name-field-a1-authors field-type-taxonomy-term-reference field-label-hidden"> <span class="field-items"> <a href="/publication-authors/dep-vanpoucke" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">D.E.P. Vanpoucke</a>, <a href="/publication-authors/s-cottenier" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">S. Cottenier</a>, <a href="/publication-authors/t-verstraelen" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">T. Verstraelen</a>, <a href="/publication-authors/v-van-speybroeck" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">V. Van Speybroeck</a>, <a href="/publication-authors/s-van-damme" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">S. Van Damme</a>, <a href="/publication-authors/p-bultinck" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">P. Bultinck</a>, <a href="/publication-authors/i-van-driessche" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">I. Van Driessche</a> </span> </div> <div class="field field-name-field-isbn-issn field-type-text field-label-hidden"> <div class="field-items"> <div class="field-item even">ISBN/ISSN:</div> </div> </div> <div class="field field-name-field-poster-or-talk field-type-list-text field-label-hidden"> <div class="field-items"> <div class="field-item even">Poster</div> </div> </div> <div class="field field-name-field-conference-name field-type-text field-label-above"> <h3><div class="field-label">Conference / event / venue&nbsp;</div></h3> <div class="field-items"> <div class="field-item even">Quantum Chemistry in Belgium</div> </div> </div> <div class="field field-name-field-conference-location field-type-text field-label-hidden"> <div class="field-items"> <div class="field-item even">Namur, Belgium</div> </div> </div> <div class="field field-name-field-conference-dates field-type-date field-label-hidden"> <div class="field-items"> <div class="field-item even"><span class="date-display-single" property="dc:date" datatype="xsd:dateTime" content="2014-01-23T00:00:00+01:00">Thursday, 23 January, 2014</span></div> </div> </div> Fri, 12 Jun 2015 11:40:45 +0000 danny 3779 at https://molmod.ugent.be https://molmod.ugent.be/c1_c3_publications/hirshfeld-i-charges-molecules-solids-implementation-pitfalls-and-applications#comments Calculating Hirschfeld-I charges in solids: implementation, pitfalls and applications https://molmod.ugent.be/c1_c3_publications/calculating-hirschfeld-i-charges-solids-implementation-pitfalls-and-applications <div class="field field-name-field-a1-authors field-type-taxonomy-term-reference field-label-hidden"> <span class="field-items"> <a href="/publication-authors/dep-vanpoucke" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">D.E.P. Vanpoucke</a>, <a href="/publication-authors/s-cottenier" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">S. Cottenier</a>, <a href="/publication-authors/v-van-speybroeck" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">V. Van Speybroeck</a>, <a href="/publication-authors/s-van-damme" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">S. Van Damme</a>, <a href="/publication-authors/p-bultinck" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">P. Bultinck</a>, <a href="/publication-authors/i-van-driessche" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">I. Van Driessche</a> </span> </div> <div class="field field-name-field-isbn-issn field-type-text field-label-hidden"> <div class="field-items"> <div class="field-item even">ISBN/ISSN:</div> </div> </div> <div class="field field-name-field-poster-or-talk field-type-list-text field-label-hidden"> <div class="field-items"> <div class="field-item even">Poster</div> </div> </div> <div class="field field-name-field-conference-name field-type-text field-label-above"> <h3><div class="field-label">Conference / event / venue&nbsp;</div></h3> <div class="field-items"> <div class="field-item even">15th International Conference on Density Functional Theory and its Applications</div> </div> </div> <div class="field field-name-field-conference-location field-type-text field-label-hidden"> <div class="field-items"> <div class="field-item even">Durham, UK</div> </div> </div> <div class="field field-name-field-conference-dates field-type-date field-label-hidden"> <div class="field-items"> <div class="field-item even"><span class="date-display-range"><span class="date-display-start" property="dc:date" datatype="xsd:dateTime" content="2013-09-09T00:00:00+02:00">Monday, 9 September, 2013</span> to <span class="date-display-end" property="dc:date" datatype="xsd:dateTime" content="2013-09-13T00:00:00+02:00">Friday, 13 September, 2013</span></span></div> </div> </div> <div class="field field-name-field-abstract-private field-type-file field-label-above"> <h3><div class="field-label">Abstract (private)&nbsp;</div></h3> <div class="field-items"> <div class="field-item even"><span class="file"><img class="file-icon" alt="PDF icon" title="application/pdf" src="/modules/file/icons/application-pdf.png" /> <a href="https://molmod.ugent.be/system/files/dft2013_VanpouckeDannyEP.pdf" type="application/pdf; length=57120">dft2013_VanpouckeDannyEP.pdf</a></span></div> </div> </div> <div class="field field-name-field-conference-reference field-type-taxonomy-term-reference field-label-above"> <h3 class="field-label">Conference reference</h3> <span class="field-items"> <a href="/conferences/dft-2013-0" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">DFT 2013</a> </span> </div> Wed, 30 Oct 2013 13:54:29 +0000 wim 2673 at https://molmod.ugent.be https://molmod.ugent.be/c1_c3_publications/calculating-hirschfeld-i-charges-solids-implementation-pitfalls-and-applications#comments Calculating Hirshfeld-I charges in solids: Implementation, pitfalls and applications https://molmod.ugent.be/c1_c3_publications/calculating-hirshfeld-i-charges-solids-implementation-pitfalls-and-applications <div class="field field-name-field-a1-authors field-type-taxonomy-term-reference field-label-hidden"> <span class="field-items"> <a href="/publication-authors/dep-vanpoucke" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">D.E.P. Vanpoucke</a>, <a href="/publication-authors/s-van-damme" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">S. Van Damme</a>, <a href="/publication-authors/s-cottenier" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">S. Cottenier</a>, <a href="/publication-authors/p-bultinck" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">P. Bultinck</a>, <a href="/publication-authors/i-van-driessche" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">I. Van Driessche</a>, <a href="/publication-authors/v-van-speybroeck" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">V. Van Speybroeck</a> </span> </div> <div class="field field-name-field-abstract-page field-type-text field-label-hidden"> <div class="field-items"> <div class="field-item even">CMN4</div> </div> </div> <div class="field field-name-field-isbn-issn field-type-text field-label-hidden"> <div class="field-items"> <div class="field-item even">ISBN/ISSN:</div> </div> </div> <div class="field field-name-field-poster-or-talk field-type-list-text field-label-hidden"> <div class="field-items"> <div class="field-item even">Talk</div> </div> </div> <div class="field field-name-field-conference-name field-type-text field-label-above"> <h3><div class="field-label">Conference / event / venue&nbsp;</div></h3> <div class="field-items"> <div class="field-item even">Belgian Physical Society Meeting</div> </div> </div> <div class="field field-name-field-conference-location field-type-text field-label-hidden"> <div class="field-items"> <div class="field-item even">Louvain-la-neuve, Belgium</div> </div> </div> <div class="field field-name-field-conference-dates field-type-date field-label-hidden"> <div class="field-items"> <div class="field-item even"><span class="date-display-single" property="dc:date" datatype="xsd:dateTime" content="2013-05-22T00:00:00+02:00">Wednesday, 22 May, 2013</span></div> </div> </div> <div class="field field-name-field-abstract-private field-type-file field-label-above"> <h3><div class="field-label">Abstract (private)&nbsp;</div></h3> <div class="field-items"> <div class="field-item even"><span class="file"><img class="file-icon" alt="PDF icon" title="application/pdf" src="/modules/file/icons/application-pdf.png" /> <a href="https://molmod.ugent.be/system/files/CMN4_Vanpoucke.pdf" type="application/pdf; length=10003">CMN4_Vanpoucke.pdf</a></span></div> </div> </div> <div class="field field-name-field-conference-reference field-type-taxonomy-term-reference field-label-above"> <h3 class="field-label">Conference reference</h3> <span class="field-items"> <a href="/conferences/bps-2013" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">BPS 2013</a> </span> </div> Wed, 15 May 2013 06:22:04 +0000 wim 2352 at https://molmod.ugent.be https://molmod.ugent.be/c1_c3_publications/calculating-hirshfeld-i-charges-solids-implementation-pitfalls-and-applications#comments