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SpecDB: A Relational Database for Archiving Biomolecular NMR Spectra Data

SpecDB: A relational database for archiving biomolecular NMR spectral data - ScienceDirect

2023 Homelab Update : r/homelab

Isobaric Quantitative Protein Interaction Reporter Technology for Comparative Interactome Studies

Tools for protein structure prediction and for molecular docking applied to enzyme active site analysis: A case study using a BAHD hydroxycinnamoyltransferase - ScienceDirect

ChemEM: Flexible Docking of Small Molecules in Cryo-EM Structures

Multi-GPU UNRES for scalable coarse-grained simulations of very large protein systems - ScienceDirect

Reliable protein-protein docking with AlphaFold, Rosetta and replica-exchange

FRET-based dynamic structural biology: Challenges, perspectives and an appeal for open-science practices

ProteinGym: Large-Scale Benchmarks for Protein Design and Fitness Prediction

Tahsin Kellici on LinkedIn: #computationalchemistry #compchem #drugdiscovery #drugdesign…

Speeding up bowtie2 by improving cache-hit rate