Molecular simulations of drug delivery systems based on halloysite
Halloysite is a clay mineral of kaolinite group which appears in different forms, but the most widely used form is the tubular structure. Due to its particular characteristics, halloysite has been used for the entrapment of various substances and for that reason it finds application as an excipient...
| Κύριος συγγραφέας: | |
|---|---|
| Άλλοι συγγραφείς: | |
| Γλώσσα: | English |
| Έκδοση: |
2022
|
| Θέματα: | |
| Διαθέσιμο Online: | https://hdl.handle.net/10889/23595 |
| id |
nemertes-10889-23595 |
|---|---|
| record_format |
dspace |
| spelling |
nemertes-10889-235952022-11-02T04:35:19Z Molecular simulations of drug delivery systems based on halloysite Μοριακή μοντελοποίηση συστημάτων χορήγησης φαρμάκων με βάση τον αλλοϋσίτη Γκούμα, Ελένη Gkouma, Eleni Halloysite 5-fluorouracil Molecular simulation Drug delivery Μοριακή προσομοίωση Μεταφορά φαρμάκου Αλλοϋσίτης 5-φθοριουρακίλη Halloysite is a clay mineral of kaolinite group which appears in different forms, but the most widely used form is the tubular structure. Due to its particular characteristics, halloysite has been used for the entrapment of various substances and for that reason it finds application as an excipient for the delivery of the drugs in human body. Molecular Simulation was used to explain the interactions between 5-fluorouracil and halloysite. In order to study the behavior of the molecules, computational models have been developed showing that halloysite can be used as a potential delivery system for the active substance, as it interacts effectively with the drug molecules. Ο αλλοϋσίτης είναι ένα αργιλικό ορυκτό της ομάδας του καολινίτη, ο οποίος μπορεί να εμφανίζεται με την πεπλατυσμένη είτε τη σφαιρική του μορφή, όμως η πλέον διαδεδομένη είναι η σωληνοειδής. Λόγω των ιδιαίτερων χαρακτηριστικών του, χρησιμοποιείται ευρέως για τη συγκράτηση διαφόρων ουσιών και γι’ αυτό βρίσκει εφαρμογή και ως έκδοχο για τη μεταφορά φαρμάκων στον οργανισμό. Η Μοριακή Προσομοίωση χρησιμοποιήθηκε για την επεξήγηση των αμοιβαίων αλληλεπιδράσεων μεταξύ της 5-φθοριουρακίλης και του αλλοϋσίτη. Για τη μελέτη της συμπεριφοράς των μορίων, δημιουργήθηκαν υπολογιστικά μοντέλα από τα οποία προκύπτει ότι ο αλλοϋσίτης μπορεί να χρησιμοποιηθεί ως ένα δυνητικό σύστημα μεταφοράς της δραστικής ουσίας, καθότι αλληλεπιδρά αποτελεσματικά με τα μόρια του φαρμάκου. 2022-11-01T11:13:45Z 2022-11-01T11:13:45Z 2021-09-17 https://hdl.handle.net/10889/23595 en application/pdf |
| institution |
UPatras |
| collection |
Nemertes |
| language |
English |
| topic |
Halloysite 5-fluorouracil Molecular simulation Drug delivery Μοριακή προσομοίωση Μεταφορά φαρμάκου Αλλοϋσίτης 5-φθοριουρακίλη |
| spellingShingle |
Halloysite 5-fluorouracil Molecular simulation Drug delivery Μοριακή προσομοίωση Μεταφορά φαρμάκου Αλλοϋσίτης 5-φθοριουρακίλη Γκούμα, Ελένη Molecular simulations of drug delivery systems based on halloysite |
| description |
Halloysite is a clay mineral of kaolinite group which appears in different forms, but the most widely used form is the tubular structure. Due to its particular characteristics, halloysite has been used for the entrapment of various substances and for that reason it finds application as an excipient for the delivery of the drugs in human body. Molecular Simulation was used to explain the interactions between 5-fluorouracil and halloysite. In order to study the behavior of the molecules, computational models have been developed showing that halloysite can be used as a potential delivery system for the active substance, as it interacts effectively with the drug molecules. |
| author2 |
Gkouma, Eleni |
| author_facet |
Gkouma, Eleni Γκούμα, Ελένη |
| author |
Γκούμα, Ελένη |
| author_sort |
Γκούμα, Ελένη |
| title |
Molecular simulations of drug delivery systems based on halloysite |
| title_short |
Molecular simulations of drug delivery systems based on halloysite |
| title_full |
Molecular simulations of drug delivery systems based on halloysite |
| title_fullStr |
Molecular simulations of drug delivery systems based on halloysite |
| title_full_unstemmed |
Molecular simulations of drug delivery systems based on halloysite |
| title_sort |
molecular simulations of drug delivery systems based on halloysite |
| publishDate |
2022 |
| url |
https://hdl.handle.net/10889/23595 |
| work_keys_str_mv |
AT nkoumaelenē molecularsimulationsofdrugdeliverysystemsbasedonhalloysite AT nkoumaelenē moriakēmontelopoiēsēsystēmatōnchorēgēsēspharmakōnmebasētonalloüsitē |
| _version_ |
1771297184712491008 |
