Check out our latest work, in which we managed to link MOF experimental data with their crystal structures and computational data through the use of a structured and extensive knowledge graph! :)
               
            
            
                03.06.2025 14:36 β π 0    π 0    π¬ 0    π 0                      
            
         
            
        
            
            
            
            
            
    
    
    
    
            A Self-Driving Lab for Nano- and Advanced Materials Synthesis https://dx.doi.org/10.26434/chemrxiv-2024-f13l1?rft_dat=source%3Ddrss
               
            
            
                09.12.2024 05:12 β π 4    π 2    π¬ 0    π 0                      
            
         
            
        
            
            
            
            
            
    
    
    
    
            Advances in Chemistry of CALF-20, a Metal-Organic Framework for Industrial Gas Applications http://pubs.rsc.org/en/Content/ArticleLanding/2025/CC/D4CC05744A
               
            
            
                05.12.2024 15:13 β π 2    π 2    π¬ 0    π 0                      
            
         
            
        
            
            
            
            
            
    
    
    
    
            Thank you!!
Not for a specific application - more so trying to capture the chemistry + geometry of MOFs with modalities that are (ideally) readily available upon synthesis to link them to applications like gas storage, band gap, etc.
               
            
            
                23.11.2024 06:43 β π 1    π 0    π¬ 0    π 0                      
            
         
            
        
            
            
            
            
            
    
    
    
    
            Hi, I would love to be added! I am doing research in AI for chemical sciences (particularly multimodality in MOFs π).
               
            
            
                23.11.2024 02:18 β π 2    π 0    π¬ 1    π 0                      
            
         
            
        
            
            
            
            
            
    
    
    
    
            Machine-learning-enhanced symbolic regression for methane storage prediction in covalent organic frameworks http://link.aps.org/doi/10.1103/PhysRevMaterials.8.115408
               
            
            
                21.11.2024 19:12 β π 1    π 1    π¬ 0    π 0                      
            
         
            
        
            
            
            
            
            
    
    
    
    
            Molecular diffusion enhanced performance evaluation of metal-organic frameworks for CO2 capture https://dx.doi.org/10.26434/chemrxiv-2024-3bh17?rft_dat=source%3Ddrss
               
            
            
                19.11.2024 05:12 β π 1    π 1    π¬ 0    π 0                      
            
         
            
        
            
            
            
            
            
    
    
    
    
            Nice to be here! Let's have a good time discussing science :)
               
            
            
                17.11.2024 19:42 β π 2    π 0    π¬ 0    π 0                      
            
         
    
         
        
            
        
                            
                    
                    
                                            #Anonymous: Actions Not Nouns. All that exists is interaction. #BindingChaos #3E https://spookyconnections.com/
                                     
                            
                    
                    
                                            AI/ML for Science & DeepTech | PI of the AI for Materials Lab | Prof. of Physics at UAM. https://bravoabad.substack.com/
                                     
                            
                    
                    
                                            Second year PhD Student @ PoliTO & EURECOM in NLP and Databases
                                     
                            
                    
                    
                                            Shapeologist: Topologist, Mathematical chemist. Recorder player. (she/her)
https://research.vu.nl/en/persons/senja-barthel
                                     
                            
                    
                    
                                            Probabilistic deep learning for atmospheric dynamics, fluids and dynamical systems || PhD student in Applied Maths, University of Cambridge || UKRI CDT in AI for Environmental Risks || website: https://www.damtp.cam.ac.uk/user/is500
                                     
                            
                    
                    
                                            Graduate student at Penn with an interest in machine learning 
                                     
                            
                    
                    
                                            Assistant Prof. @uoknightcampus.bsky.social. Cofounder @synplexity.bsky.social. Gene synthesis, synbio, protein engineering, nanopores, multiplex assays. Opinions my own. www.plesalab.org
                                     
                            
                    
                    
                                            Boya Postdoctoral Fellow @PKU | formally @corrylab.bsky.social, ANU
MD simulations of lipids and membrane proteins 
Like PIP2, I am negatively charged in the head 
                                     
                            
                    
                    
                                            Protein and coffee lover, father of two, professor of biophysics and sudo scientist at the  LinderstrΓΈm-Lang Centre for Protein Science, University of Copenhagen π©π°
                                     
                            
                    
                    
                                            Professor at UC San Diego. Computational biophysics, biology, chemistry. Multiscale modeler. Viruses. Cancer. Co-Director of the Airborne Institute.
                                     
                            
                    
                    
                                    
                            
                    
                    
                                            Prof of Computational Microbiology. Oxford Biochemistry & St Anneβs College. Bacterial Cell Envelopes. LFC fan π
                                     
                            
                    
                    
                                            Professor of Computational Biochemistry. School of Life Sciences & Department of Chemistry, University of Warwick. Molecular Modeller of Membrane Proteins, Bacterial Biogenesis & Antimicrobial Resistance.
                                     
                            
                    
                    
                                            Associate Professor of Biochemistry at Virginia Tech. Comp Chem, CADD, and Drude FF contributor. Opinions my own. Go Hokies!
                                     
                            
                    
                    
                                            Assistant Professor in Pharmacology at University of Bristol | GPCRs and ion channels | molecular modelling and simulation | drugs and lipids
                                     
                            
                    
                    
                                            Computational biophysicist, prof at KTH, Stockholm. Loves membrane proteins and mathematical models. Mom of twin toddlers. π«π·πΈπͺ
                                     
                            
                    
                    
                                            Postdoctoral Researcher @MIPS Monash Uni in Melbourne. Interested in GPCR π§ cryoEM βπ¬ SciVisππ‘π¨ Views and Arts are my own. Founder of @PiperProteins | PiperProteinProductions
She/her
                                     
                            
                    
                    
                                            Computational biochemist, interested in neuronal signalling at the atomic level and computer-aided drug design.  All views my own.
@bigginlab@fediscience.org @philbiggin@X
bigginlab.web.ox.ac.uk
                                     
                            
                    
                    
                                            Computational protein research group of Prof Ben Corry. 
We love molecular dynamics and all kinds of membrane proteins including ion channels, transporters and immune receptors
~Posts by group members
                                     
                            
                    
                    
                                            Computational biophysicist | loves lipids and ion channels | bakes, reads, plays board games, runs a little island on animal crossing, collects stamps and stickers, also loves reading about writing