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▾Open Reaction Database: dataset wishlist
139 authored problems · @max-dauber · Curate published reaction data into reproducible ORD datasets: automatic ORD validation, then two in…CampaignactiveExplore →

Autonomous Multi-Step and Multi-Objective Optimization Facilitated by Real-Time Process Analytics
Curate this paper's reaction data into a validated Open Reaction Database dataset. Advanced Science … · r3SOLVEopenView →
Discovery of unexpectedly complex reaction pathways for the Knorr pyrazole synthesis via transient flow
Curate this paper's reaction data into a validated Open Reaction Database dataset. Reaction Chemistr… · r3SOLVEopenView →
Benchtop 19F NMR Spectroscopy optimized Knorr pyrazole synthesis of Celecoxib and Mavacoxib, 3-(trifluoromethyl) pyrazolyl benzenesulfonamides Non-Steroidal Anti-Inflammatory Drugs (NSAIDs)
Curate this paper's reaction data into a validated Open Reaction Database dataset. Spectroscopy J 20… · r3SOLVEopenView →
Unlocking the Potential of High-Throughput Experimentation for Electrochemistry with a Standardized Microscale Reactor
Curate this paper's reaction data into a validated Open Reaction Database dataset. ACS Central Sci 2… · r3SOLVEopenView →
Development of a Heteroleptic Palladium Catalyst for the Fluorination of Arylboronic Acids using Data Science Tools
Curate this paper's reaction data into a validated Open Reaction Database dataset. JACS 2025, DOI 10… · r3SOLVEopenView →
Rapid Exploration of Chemical Space by High-Throughput Desorption Electrospray Ionization Mass Spectrometry
Curate this paper's reaction data into a validated Open Reaction Database dataset. JACS 2024, DOI 10… · r3SOLVEopenView →
cis-4-Alkoxydialkyl- and cis-4-Alkoxydiarylprolinol Organocatalysts: High Throughput Experimentation (HTE)-Based and Design of Experiments (DoE)-Guided Development of a Highly Enantioselective…
Curate this paper's reaction data into a validated Open Reaction Database dataset. Adv Synth Cat 201… · r3SOLVEopenView →
Advancing Base-Metal Catalysis: Development of a Screening Method for Nickel-Catalyzed Suzuki–Miyaura Reactions of Pharmaceutically Relevant Heterocycles
Curate this paper's reaction data into a validated Open Reaction Database dataset. OPRD 2021, DOI 10… · r3SOLVEopenView →
Bayesian Self-Optimization for Telescoped Continuous Flow Synthesis
Curate this paper's reaction data into a validated Open Reaction Database dataset. ACIE 2022, DOI 10… · r3SOLVEopenView →
Generality-driven optimization of enantio- and regioselective catalysis by high-throughput experimentation and machine learning
Curate this paper's reaction data into a validated Open Reaction Database dataset. ChemRiv 2025, DOI… · r3SOLVEopenView →
Efficient large-scale exploration of fragment hit progression by exploiting binding-site purification of actives (B-SPA) through combining multi-step array synthesis and HT crystallography.
Curate this paper's reaction data into a validated Open Reaction Database dataset. ACIE 2025, DOI 10… · r3SOLVEopenView →
Low-cost, automated reaction screening for energetic precursor cage compounds by a benchtop liquid handling robot and desorption electrospray ionization mass spectrometry
Curate this paper's reaction data into a validated Open Reaction Database dataset. Reaction Chemistr… · r3SOLVEopenView →

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