
HanSun_lab
1.4K posts

HanSun_lab
@HanSun_lab
We work on drug-like molecules and characterize their interactions with proteins. #NMR #MDSimulation #cheminformatics #bioinformatics @LeibnizFMP and @TUBerlin


The first paper from our @synpepbio graduate student! We assessed the performance of a high number of DFT functionals in predicting chemical shielding tensors and evaluated their impact on structure elucidation using anisotropic NMR data. pubs.acs.org/doi/10.1021/ac…


Semisupervised Contrastive Learning for Bioactivity Prediction Using Cell Painting Image Data #machinelearning #compchem pubs.acs.org/doi/abs/10.102…




Exciting news! @LeibnizFMP, @kieluni & @LeibnizLIV are starting new project, supported through "Leibniz CooperativeExcellence" program. Goal: Unravel mechanisms of K2P potassium channels – with potential new therapeutic approaches. leibniz-fmp.de/newsroom/news/… #LeibnizWGL @HanSun_lab

I am honored to receive the 2024 Early Career @Einstein_Berlin Award together with @helenajambor for our project "PixelQuality: Best Practices for Publishing Images": award.einsteinfoundation.de/award-winners-… Thank you to our amazing team @QuarepLimi and my hosts @EuOpenscreen and @LeibnizFMP




Today we release the first set of #opensource Cell Painting Data generated in the @EuOpenscreen network by @LeibnizFMP, @IMTM_Olomouc, @MEDINADiscovery, @UniversidadeUSC and @imgprague. Bioactive compounds over Hep G2 and U2-OS and 4 sites. Preprint: doi.org/10.1101/2024.0…




Introducing the Revamped Editorial Team and Exciting Changes at @MagnResonChem (MRC). Read our new Editorial …iencejournals.onlinelibrary.wiley.com/doi/full/10.10…

