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- Currently displaying 9001 - 9020 of 31588 publications
Artificial intelligence for predicting molecular electrostatic potentials (ESPs): A step towards developing ESP-guided knowledge-based scoring functions
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2018)
256
Analysing matched molecular pair transformations in drug discovery projects as a function of time and molecular environment
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2018)
256
Information-derived adverse outcome pathways with a case study on structural cardiotoxicity
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2018)
256
Bio-inspired photonics: From nature to applications
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2018)
256
Advances in computational NMR structure elucidation by DP4: Automation, optimisation and raw data analysis
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2018)
256
Engineered excitonic materials on programmable scaffolds
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2018)
256
Identifying the Structural Evolution of the Sodium Ion Battery Na
Angew Chem Int Ed Engl
(2018)
57
11918
(doi: 10.1002/anie.201805555)
Gearing transcriptomics towards high-throughput screening: Compound shortlisting from gene expression using in silico information
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2018)
256
Understanding the effect of arsenic treatment on breast cancer cell lines using gene expression analysis
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2018)
256
Chemistry librarians and disciplinary data repositories working in partnership
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2018)
256
Site-selective generation of stable antibody-drug conjugates via cysteine bridging of native antibodies
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2018)
256
Understanding drug and compound combinations and modelling synergy - Methods and applications
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2018)
256
Data-driven many-body representations with chemical accuracy for molecular simulations from the gas to the condensed phase
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2018)
256
Hydrogen bonding: Ab initio accuracy from fast interatomic Gaussian approximation potentials
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2018)
256
Diversity-oriented synthesis for the generation of N-substituted quaternary carbon containing small molecules from α,α-disubstituted propargyl amino esters
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2018)
256
Covalent post-assembly modification triggers multiple structural transformations of a tetrazine-edged Fe4L6 tetrahedron
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2018)
256
Signal transduction in a covalent post-assembly modification cascade
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2018)
256
International chemical identifier for reactions (RInChI): The key to managing reaction databases effectively
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2018)
256
Ultrafast logic computation using nanostructured Ge-Sb-Te phase-change memory materials
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2018)
256
MD-assisted approach for designing multi-target ligands at A2AR and PDE10A that elevate cyclic AMP
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2018)
256
