Ascalaph Designer (original) (raw)
Ascalaph Designer is a computer program for general purpose molecular modelling for molecular design and simulations. It provides a graphical environment for the common programs of quantum and classical molecular modelling ORCA, NWChem, Firefly, CP2K and MDynaMix . The molecular mechanics calculations cover model building, energy optimizations and molecular dynamics. Firefly (formerly named PC GAMESS) covers a wide range of quantum chemistry methods. Ascalaph Designer is free and open-source software, released under the GNU General Public License, version 2 (GPLv2).
| Property | Value |
|---|---|
| dbo:Software/fileSize | 138.9 (dbd:megabyte) |
| dbo:abstract | Ascalaph Designer is a computer program for general purpose molecular modelling for molecular design and simulations. It provides a graphical environment for the common programs of quantum and classical molecular modelling ORCA, NWChem, Firefly, CP2K and MDynaMix . The molecular mechanics calculations cover model building, energy optimizations and molecular dynamics. Firefly (formerly named PC GAMESS) covers a wide range of quantum chemistry methods. Ascalaph Designer is free and open-source software, released under the GNU General Public License, version 2 (GPLv2). (en) Ascalaph Designer — программа молекулярного моделирования общего назначения. Она предоставляет графическое окружение для консольных программ квантовой и классической механики Firefly, и , имеет возможности для конструирования молекулярных моделей, конформационной оптимизации и молекулярной динамики. Firefly/PC GAMESS предоставляет широкий ряд квантовохимических методов. (ru) Ascalaph Designer — програма молекулярного моделювання загального призначення. Вона дає графічний інтерфейс для консольних програм квантової і класичної механіки , s , має можливості для конструювання молекулярних моделей, інформаційної оптимізації та молекулярної динаміки. пропонує низку квантовохімічних методів. (uk) |
| dbo:computingPlatform | dbr:X86 |
| dbo:fileSize | 138900000.000000 (xsd:double) |
| dbo:genre | dbr:Molecular_modelling |
| dbo:latestReleaseDate | 2015-12-03 (xsd:date) |
| dbo:latestReleaseVersion | 1.8.94 |
| dbo:license | dbr:GNU_GPL dbr:Code_Project_Open_License |
| dbo:operatingSystem | dbr:Microsoft_Windows |
| dbo:programmingLanguage | dbr:C++ |
| dbo:thumbnail | wiki-commons:Special:FilePath/DNA-in-Ascalaph-Designer.png?width=300 |
| dbo:wikiPageExternalLink | http://sourceforge.net/projects/asc-designer https://twitter.com/agilemolecule |
| dbo:wikiPageID | 22640378 (xsd:integer) |
| dbo:wikiPageLength | 7696 (xsd:nonNegativeInteger) |
| dbo:wikiPageRevisionID | 1050154179 (xsd:integer) |
| dbo:wikiPageWikiLink | dbr:Quantum_chemistry dbr:DNA dbr:OPLS dbr:Nucleic_acid dbr:Optimization_(mathematics) dbr:Free_and_open-source_software dbr:GNU_GPL dbr:GNU_General_Public_License dbr:Molecular_mechanics dbr:MDynaMix dbr:Computer_program dbr:C++ dbr:CP2K dbr:Ionic_liquid dbr:Lipid_bilayer dbr:AMBER dbr:Abalone_(molecular_mechanics) dbc:Free_science_software dbr:Firefly_(computer_program) dbr:Flexible_SPC_water_model dbr:Force_field_(chemistry) dbr:Molecular_dynamics dbr:Protein dbc:Computational_chemistry_software dbc:Molecular_dynamics_software dbc:Molecular_modelling_software dbr:Code_Project_Open_License dbr:Microsoft_Windows dbr:X86 dbr:NWChem dbr:Molecular_design_software dbr:Molecular_model dbr:Molecular_modelling dbr:Molecule_editor dbr:Polyelectrolyte dbr:ORCA_(Quantum_Chemistry_Program) dbr:List_of_software_for_molecular_mechanics_modeling |
| dbp:author | Alexei Nikitin (en) |
| dbp:caption | Ascalaph Designer renders deoxyribonucleic acid (en) |
| dbp:developer | Agile Molecule (en) |
| dbp:genre | dbr:Molecular_modelling |
| dbp:language | English (en) |
| dbp:latestReleaseDate | 2015-12-03 (xsd:date) |
| dbp:latestReleaseVersion | 1.800000 (xsd:double) |
| dbp:license | GNU GPL and others including Code Project Open License (en) |
| dbp:name | Ascalaph Designer (en) |
| dbp:operatingSystem | dbr:Microsoft_Windows |
| dbp:platform | dbr:X86 |
| dbp:programmingLanguage | dbr:C++ |
| dbp:screenshot | Image:DNA-in-Ascalaph-Designer.png (en) |
| dbp:screenshotAlt | Computer rendering of colored space filling molecular diagram of deoxyribonucleic acid made with Ascalaph Designer (en) |
| dbp:size | 138.9 MB (en) |
| dbp:wikiPageUsesTemplate | dbt:Columns-list dbt:Infobox_software dbt:Official_website dbt:Reflist dbt:Start_date_and_age dbt:URL dbt:Chemistry_software |
| dct:subject | dbc:Free_science_software dbc:Computational_chemistry_software dbc:Molecular_dynamics_software dbc:Molecular_modelling_software |
| gold:hypernym | dbr:Package |
| rdf:type | owl:Thing dbo:Software schema:CreativeWork dbo:Work wikidata:Q386724 wikidata:Q7397 |
| rdfs:comment | Ascalaph Designer is a computer program for general purpose molecular modelling for molecular design and simulations. It provides a graphical environment for the common programs of quantum and classical molecular modelling ORCA, NWChem, Firefly, CP2K and MDynaMix . The molecular mechanics calculations cover model building, energy optimizations and molecular dynamics. Firefly (formerly named PC GAMESS) covers a wide range of quantum chemistry methods. Ascalaph Designer is free and open-source software, released under the GNU General Public License, version 2 (GPLv2). (en) Ascalaph Designer — программа молекулярного моделирования общего назначения. Она предоставляет графическое окружение для консольных программ квантовой и классической механики Firefly, и , имеет возможности для конструирования молекулярных моделей, конформационной оптимизации и молекулярной динамики. Firefly/PC GAMESS предоставляет широкий ряд квантовохимических методов. (ru) Ascalaph Designer — програма молекулярного моделювання загального призначення. Вона дає графічний інтерфейс для консольних програм квантової і класичної механіки , s , має можливості для конструювання молекулярних моделей, інформаційної оптимізації та молекулярної динаміки. пропонує низку квантовохімічних методів. (uk) |
| rdfs:label | Ascalaph Designer (en) Ascalaph Designer (ru) Ascalaph Designer (uk) |
| owl:sameAs | freebase:Ascalaph Designer wikidata:Ascalaph Designer dbpedia-ru:Ascalaph Designer dbpedia-uk:Ascalaph Designer https://global.dbpedia.org/id/3jT1g |
| prov:wasDerivedFrom | wikipedia-en:Ascalaph_Designer?oldid=1050154179&ns=0 |
| foaf:depiction | wiki-commons:Special:FilePath/DNA-in-Ascalaph-Designer.png |
| foaf:homepage | http://www.biomolecular-modeling.com/Ascalaph |
| foaf:isPrimaryTopicOf | wikipedia-en:Ascalaph_Designer |
| foaf:name | Ascalaph Designer (en) |
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