000 | a | ||
---|---|---|---|
999 |
_c15577 _d15577 |
||
003 | OSt | ||
005 | 20211124101222.0 | ||
008 | 211124b xxu||||| |||| 00| 0 eng d | ||
040 |
_aAIKTC-KRRC _cAIKTC-KRRC |
||
100 |
_914788 _aChitre, Trupti Sameer |
||
245 | _a Designing of Thiazolidin-4-one Pharmacophore using QSAR Studies for Anti-HIV Activity | ||
250 | _aVol.55(2), Apr-Jun | ||
260 |
_aBanaglore _bAssociation of Pharmaceutical Teachers of India (APTI) _c2021 |
||
300 | _a581-589p. | ||
520 | _aBackground and Aim: In an effort of drug development in the area of HIV, present work deals with development of 2D and 3D QSAR of thiazolidinone derivatives against HIV-RT activity as a powerful method for elucidation the relationships between structure and activity. Materials and Methods: 2D QSAR and 3D QSAR were performed using MLR and SA kNN method respectively. Models which had higher predictability were generated as indicated from their statistical parameters. Results and Discussion: Best models generated showed correlation coefficient r2= 0.9256 and q2 =0.8623 for 2D QSAR and q2 =0.8444 for 3D QSAR. The models indicated the requirement of electro topological, electrostatic and steric descriptors which would significantly contribute to HIV-RT inhibitory activity. Further a few compounds were designed using the outcome of QSAR studies. | ||
650 | 0 |
_94639 _aPHARMACEUTICS |
|
700 |
_914789 _aPatil, Shital Manoj |
||
773 | 0 |
_x0019-5464 _tIndian journal of pharmaceutical education and research _dBengluru Association of Pharmaceutical Teachers of India (APTI) |
|
856 |
_uhttps://www.ijper.org/sites/default/files/IndJPhaEdRes-55-2-581.pdf _yClick here |
||
942 |
_2ddc _cAR |