https://www.fc.up.pt/PortoBioComp/database/ 2026-04-04T18:11:27+01:00 https://www.fc.up.pt/PortoBioComp/database/ https://www.fc.up.pt/PortoBioComp/database/lib/tpl/dokuwiki/images/favicon.ico text/html 2018-10-11T17:17:59+01:00 nuno https://www.fc.up.pt/PortoBioComp/database/doku.php?id=molup&rev=1539274679&do=diff Operating systems: macOS, Linux, and Windows (NEW) Contacts : Henrique Silva Fernandes Maria João Ramos Nuno Sousa Cerqueira ---------- 1. Introduction molUP is a VMD extension that provides a simple manner for loading and saving Gaussian files, and analyze related results. molUP provides a graphical interface for VMD where the users can load and save chemical structures in the Gaussian file formats. This extension includes a set of tools to set up any calculation supported by Gaussian, … text/html 2017-08-04T13:50:44+01:00 nuno https://www.fc.up.pt/PortoBioComp/database/doku.php?image=molup_linux00003.png&ns=&rev=1501851044&tab_details=history&mediado=diff&do=media <img src="/PortoBioComp/database/lib/exe/fetch.php?w=500&h=307t=1501851044&amp;tok=60b36b&amp;media=molup_linux00003.png" alt="molup_linux00003.png" /> text/html 2017-08-04T13:50:19+01:00 nuno https://www.fc.up.pt/PortoBioComp/database/doku.php?image=molup_linux00002.png&ns=&rev=1501851019&tab_details=history&mediado=diff&do=media <img src="/PortoBioComp/database/lib/exe/fetch.php?w=500&h=307t=1501851019&amp;tok=0c1a70&amp;media=molup_linux00002.png" alt="molup_linux00002.png" /> text/html 2017-08-04T13:50:19+01:00 nuno https://www.fc.up.pt/PortoBioComp/database/doku.php?image=molup_linux00001.png&ns=&rev=1501851019&tab_details=history&mediado=diff&do=media <img 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https://www.fc.up.pt/PortoBioComp/database/doku.php?image=software%3Avmdmagazine%3Adownload%3Atransition_states.zip&ns=software%3Avmdmagazine%3Adownload&rev=1498820295&tab_details=history&mediado=diff&do=media text/html 2017-06-30T11:56:08+01:00 nuno https://www.fc.up.pt/PortoBioComp/database/doku.php?image=software%3Avmdmagazine%3Ats%3Ascreen_shot_2017-06-30_at_12.01.21.png&ns=software%3Avmdmagazine%3Ats&rev=1498820168&tab_details=history&mediado=diff&do=media <img src="/PortoBioComp/database/lib/exe/fetch.php?w=497&h=500t=1498820168&amp;tok=32581c&amp;media=software:vmdmagazine:ts:screen_shot_2017-06-30_at_12.01.21.png" alt="software:vmdmagazine:ts:screen_shot_2017-06-30_at_12.01.21.png" /> text/html 2017-06-30T11:52:45+01:00 nuno https://www.fc.up.pt/PortoBioComp/database/doku.php?image=software%3Avmdmagazine%3Adownload%3Adrugs.zip&ns=software%3Avmdmagazine%3Adownload&rev=1498819965&tab_details=history&mediado=diff&do=media text/html 2017-06-30T11:52:05+01:00 nuno 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2017-06-30T11:51:50+01:00 nuno https://www.fc.up.pt/PortoBioComp/database/doku.php?image=software%3Avmdmagazine%3Apdrugs%3Ascreen_shot_2017-06-30_at_11.54.58.png&ns=software%3Avmdmagazine%3Apdrugs&rev=1498819910&tab_details=history&mediado=diff&do=media <img src="/PortoBioComp/database/lib/exe/fetch.php?w=500&h=363t=1498819910&amp;tok=b1643a&amp;media=software:vmdmagazine:pdrugs:screen_shot_2017-06-30_at_11.54.58.png" alt="software:vmdmagazine:pdrugs:screen_shot_2017-06-30_at_11.54.58.png" /> text/html 2017-06-30T11:47:51+01:00 nuno https://www.fc.up.pt/PortoBioComp/database/doku.php?image=software%3Avmdmagazine%3Adownload%3Aprotein_structure.zip&ns=software%3Avmdmagazine%3Adownload&rev=1498819671&tab_details=history&mediado=diff&do=media text/html 2017-06-30T11:47:18+01:00 nuno 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