Kumari, P., Van Laethem, T., Duroux, D., Fillet, M., Hubert, P., Sacre, P.-Y., & Hubert, C. (04 September 2023). A multi-target QSRR approach to model retention times of small molecules in RPLC. Journal of Pharmaceutical and Biomedical Analysis, 236, 115690. doi:10.1016/j.jpba.2023.115690 |
Kumari, P., Van Laethem, T., Hubert, P., Fillet, M., Sacre, P.-Y., & Hubert, C. (10 February 2023). Quantitative Structure Retention-Relationship Modeling: Towards an Innovative General-Purpose Strategy. Molecules, 28 (4), 1696. doi:10.3390/molecules28041696 |
Priyanka Kumari, Van Laethem, T., Hubert, P., Fillet, M., Sacre, P.-Y., & Hubert, C. (01 February 2023). A multi-target QSRR(mT-QSRR) approach to model retention time of small pharmaceutical compounds in RPLC [Paper presentation]. CIRM DAY 2023, Liege, Belgium. |
Van Laethem, T., Kumari, P., Boulanger, B., Hubert, P., Fillet, M., Sacre, P.-Y., & Hubert, C. (28 November 2022). User-Driven Strategy for In Silico Screening of Reversed-Phase Liquid Chromatography Conditions for Known Pharmaceutical-Related Small Molecules. Molecules, 27 (23), 8306. doi:10.3390/molecules27238306 |
Kumari, P., Van Laethem, T., Hubert, P., Fillet, M., Sacre, P.-Y., & Hubert, C. (04 July 2022). QSRR for small pharmaceutical compounds in RPLC: A Machine learning approach [Paper presentation]. 18th Chemometrics in Analytical Chemistry Conference, Rome, Italy. |
Van Laethem, T., Kumari, P., Hubert, P., Fillet, M., Sacre, P.-Y., & Hubert, C. (June 2022). A pharmaceutical-related molecules dataset for reversed-phase chromatography retention time prediction built on combining pH and gradient time conditions. Data in Brief, 42, 108017. doi:10.1016/j.dib.2022.108017 |
Van Laethem, T., Kumari, P., Fillet, M., Hubert, P., Hubert, C., & Sacre, P.-Y. (18 May 2022). In-silico screening for the development of robust reversed-phase liquid chromatography methods of known small molecules based on QSRR and desirability index [Paper presentation]. 17th International Symposium on Hyphenated Techniques in Chromatography and Separation Technology (HTC-17), Gent, Belgium. |
Van Laethem, T., Kumari, P., Fillet, M., Hubert, P., Hubert, C., & Sacre, P.-Y. (02 February 2022). Elaboration of a strategy for in silico screening for reversed-phase liquid chromatography method development [Paper presentation]. CIRM-day 2022, Liège, Belgium. |
Kumari, P., Bikram Pradhan, Maria Koromina, George P. Patrinos, & Van Steen, K. (2022). Discovery of new drug indications for COVID- 19: A drug repurposing approach. PLoS ONE, 17 (5), 0267095. doi:10.1371/journal.pone.0267095 |
Van Laethem, T., Kumari, P., Fillet, M., Hubert, P., Hubert, C., & Sacre, P.-Y. (05 October 2021). Modélisation du temps de rétention de petites molécules pharmaceutiques en chromatographie liquide en phase inverse basée sur le QSRR et les surfaces de réponse [Poster presentation]. 14ème Congrès Francophone sur les Sciences Séparatives et les Couplages de l'AFSEP, Paris, France. |
Kumari, P., Van Laethem, T., Hubert, P., Fillet, M., Hubert, C., & Sacre, P.-Y. (22 July 2021). A QSRR modelling of small pharmaceutical compounds in Reverse Phase Liquid Chromatography [Paper presentation]. MLSS 2021 TAIPEI (Machine Learning Summer School), TAIPEI, Taiwan. |
Van Laethem, T., Kumari, P., Hubert, P., Fillet, M., Hubert, C., & Sacre, P.-Y. (24 May 2021). Adaptive response surface model of small pharmaceutical compounds in reverse phase liquid chromatography [Paper presentation]. CIRM-day 2021, Liège, Belgium. |
Kumari, P., Van Laethem, T., Hubert, P., Fillet, M., Hubert, C., & Sacre, P.-Y. (03 February 2021). Quantitative structure-retention relationship modelling of small pharmaceutical compounds in reverse phase liquid chromatography [Paper presentation]. Chimiométrie. |
Kumari, P., Van Laethem, T., Hubert, P., Fillet, M., Hubert, C., & Sacre, P.-Y. (03 February 2021). Quantitative structure-retention relationship modelling of small pharmaceutical compounds in reverse phase liquid chromatography [Paper presentation]. e-CHIMIOMETRIE 2021. |
Kumari, P., Van Laethem, T., Hubert, P., Fillet, M., Sacre, P.-Y., & Hubert, C. (2021). QSRR modelling of small pharmaceutical compounds in Liquid Chromatography [Paper presentation]. Summer Research internship, Milan, Italy. |