AMBrosia Space just got bigger!
Now 126B+ compounds for real-world drug discovery, with 24% more building blocks and 10 new reactions.
Built in collaboration with Ambinter, designed for hit finding and lead optimization.
Explore now: www.biosolveit.de/chemical-spa...
13.06.2025 08:50 โ ๐ 1 ๐ 0 ๐ฌ 0 ๐ 0
Great to be at FiMC in Erlangen last week.
We presented a poster on covalent Chemical Space Docking and hosted a hands-on bioisostere workshop in SeeSAR.
Thanks to everyone who joined the discussions!
#DrugDiscovery #SeeSAR #FiMC #BioSolveIT
09.04.2025 07:36 โ ๐ 0 ๐ 0 ๐ฌ 0 ๐ 0
Workshop: Next Generation of Compound Catalogs: Trillion-Sized eXplore Chemical Space @ San Diego โข BioSolveIT
We are excited to announce a collaborative workshop between BioSolveIT and eMolecules, focusing on the Trillion-Sized eXplore Chemical Space. This
Workshop | San Diego | Apr 15
Discover the Trillion-Sized Chemical Space with BioSolveIT & eMolecules (@emolecules.bsky.social)
Hands-on sessions with the eXplore Space and more, followed by a happy hour for netowrking ๐ฅ๐ค.
๐ Register using the link below
#DrugDiscovery #CADD #ChemicalSpace
04.04.2025 10:34 โ ๐ 1 ๐ 2 ๐ฌ 0 ๐ 0
Lead Optimization
Lead optimization improves the potency and selectivity of a hit compound evolving it into a full-fledged drug candidate.
โWe found a weak hit molecule and want to improve it.โ
Thereโs potentialโbut it needs work.
We can help you explore analogs, analyze interactions, and optimize compounds with clear visual guidance.
Learn more here: ๐ www.biosolveit.de/drug-discove...
#DrugDiscovery #LeadOptimization #CompChem
31.03.2025 11:21 โ ๐ 3 ๐ 0 ๐ฌ 0 ๐ 0
Binding Site Prediction
Binding site prediction plays a key role in rational drug design. To improve your compound, knowledge about interactions is required.
โWe donโt know how our compounds bind.โ
A common challenge in early-stage drug discovery.
Predicting binding sites and binding modes turns guesswork into insightโfast and visual.
Curious how it works in practice?
๐ www.biosolveit.de/binding-site...
#DrugDiscovery #CompChem #MedChem #BioSolveIT
24.03.2025 15:07 โ ๐ 1 ๐ 0 ๐ฌ 0 ๐ 0
Webinar on Advancing Efficient GPCR Drug Discovery via Computational Methods
Modern drug discovery is a long and tedious process which takes, on average, at least 10 years and 2 billion USD to bring a drug to market. One of the
Join our webinar with Prof. Dr. Shuguang Yuan (Chinese Academy of Sciences) to explore how AI & computational biology accelerate GPCR drug discovery. Learn from real-world successes advancing drugs to clinical trials.
๐
Date: March 27, 2025
๐ Time: 16:00 CET
๐ Location: Online
Register below ๐
19.03.2025 11:49 โ ๐ 0 ๐ 0 ๐ฌ 0 ๐ 0
BioSolveIT announces its launch on BlueSky, inviting followers to stay updated on drug discovery innovations, molecular design insights, and team events. The post welcomes users with an enthusiastic greeting and encourages them to follow for updates and discussions related to computational chemistry and drug discovery.
Hello, BlueSky! โ๏ธ BioSolveIT has landed!
Weโre bringing drug discovery and computational chemistry to BlueSky!
Get ready for:
โ๏ธ Updates on drug discovery innovations
โ๏ธ Insights to speed up research
โ๏ธ Fun team & event highlights
โฆand much more!
#BioSolveIT #DrugDiscovery #ComputationalChemistry
17.03.2025 14:37 โ ๐ 2 ๐ 0 ๐ฌ 0 ๐ 0
Scientific Software Solutions to Innovate...
Research Group at DCBP UniBern
#Cheminformatics | #PeptideChemistry | #SmallMolecule | #DrugDiscovery | #OrganicSynthesis
Teaching computers chemistry. Helping data sets with people problems. Sailing the sea. Opinions my own.
Professor for Molecular Drug Targeting; University of Vienna, Dept. for Pharm Sci; Max F. Perutz Labs Vienna; Co-founder of Cutanos GmbH
deep learning enjoyer, science evangelist
PI@KlahnLab, CEO@naconLabs - Natural product, MedChem and Chemical Biology enthusiast #SpotlightonSynthesis, #SpotlightonChemicalBiology, #BioinspiredToolCompounds, #InspiredbyNaturesDesign
www.klahnlab.de, ORCID 0000-0003-4713-2345
organising drug discovery data @ChEMBL, editor @jcheminf, loves sciene, yoga, writing, running, nature. mother of three. she/her
discovery chemistry nerd @Merckgroup; oncology, immunology, targeted protein degradation, ADCs; soccer, politics, tapas can slip into the feed; my own views
Lead Scientist @ Sygnature Discovery, UK
Drug Discovery, CompChem, MD, Gen AI, Knime, ML
Posts are personal!
๐ฎ๐ณ๐บ๐ธ๐ช๐ช๐ฌ๐ง
The official feed of the European Federation for Medicinal chemistry and Chemical biology.
The Laboratoire de Chimie Thรฉorique (LCT) is a joint
@sorbonne-universite.fr & @cnrs.fr Research Center (UMR 7616) dedicated to Theoretical & Computational Chemistry (Paris, France).
#compchem #compchemsky #chemsky
International non-profit developing safe, effective, and affordable treatments for the most neglected patients.
Acta Crystallographica Section D: Structural Biology is a leading structural biology journal published by the IUCr. journals.iucr.org/d
Organic Chemist
Senior Business Analyst
The CCDC is a non-profit, charitable institution focused on the advancement & promotion of chemistry & crystallography.
Website: https://www.ccdc.cam.ac.uk/
Seasoned drug designer. Former Big Pharma (AZ). Leading Cheminformatics & Data Science team in US biotech (Treeline). Based in Gรถteborg, Sweden.
Cheminformatics. Consultant https://www.warr.com. Attendee at many compchem/cheminf meetings. Writer
A clinical-stage biotechnology company developing novel cell therapies for unmet medical needs. NYSE: LCTX
Join the conversation on the latest in healthcare innovation for humans and animals. #LifeForward
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