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PhysNet: A Neural Network for Predicting Energies, Forces, Dipole Moments, and Partial Charges
American Chemical Society | 2019| -
Toolkit for the Construction of Reproducing Kernel-Based Representations of Data: Application to Multidimensional Potential Energy Surfaces
American Chemical Society | 2017| -
Asymmetric Vinylogous Mukaiyama Aldol Reaction of Aldehyde-Derived Dienolates
American Chemical Society | 2011| -
A Unifying Structural and Electronic Concept for Hmd and [FeFe] Hydrogenase Active Sites
American Chemical Society | 2010| -
Theoretical Study of Dioxygen Induced Inhibition of [FeFe]-Hydrogenase
American Chemical Society | 2009| -
Molecular Oxygen Formation in Interstellar Ices Does Not Require Tunneling
American Chemical Society | 2018| -
Correction to Theoretical Study of Dioxygen Induced Inhibition of [FeFe]-Hydrogenase
American Chemical Society | 2014| -
Corrections to Theoretical Study of Dioxygen Induced Inhibition of [FeFe]-Hydrogenase
American Chemical Society | 2010| -
Synthesis of β-Amino Acids Based on Oxidative Cleavage of Dihydropyridone Derivatives
American Chemical Society | 2004| -
Activation Barriers of Oxygen Transformation at the Active Site of [FeFe] Hydrogenases
American Chemical Society | 2014| -
Kinetic Modeling of Hydrogen Conversion at [Fe] Hydrogenase Active-Site Models
American Chemical Society | 2013| -
Analysis of Recalcitrant Hexahydrodibenzothiophenes in Petroleum Products Using a Simple Fractionation Process
American Chemical Society | 2009| -
Bending and Twisting Lattice Tilt in Strained Core–Shell Nanowires Revealed by Nanofocused X‑ray Diffraction
American Chemical Society | 2017| -
Comment on Authenticity and Traceability of Vanilla Flavors by Analysis of Stable Isotopes of Carbon and Hydrogen
American Chemical Society | 2015| -
Rheology of Small Spherical Polystyrene Microgels: A Direct Proof for a New Transport Mechanism in Bulk Polymers besides Reptation
National licenceAmerican Chemical Society | 1995| -
Impact of the Characteristics of Quantum Chemical Databases on Machine Learning Prediction of Tautomerization Energies
American Chemical Society | 2021| -
Nitrophenolate as a Building Block for Lanthanide Chains, Layers, and Clusters
American Chemical Society | 2004| -
Kinetic Consequences of Introducing a Proximal Selenocysteine Ligand into Cytochrome P450cam
American Chemical Society | 2015| -
Automatic Identification of Proteins with a MALDI-Quadrupole Ion Trap Mass Spectrometer
American Chemical Society | 2001| -
Photoinduced Tip–Sample Forces for Chemical Nanoimaging and Spectroscopy
American Chemical Society | 2018| -
Disparate Impact of the S33V Mutation on Conformational Stability in Rat β-Parvalbumin (Oncomodulin) and Chicken Parvalbumin 3
American Chemical Society | 2010| -
Enzymatic Timing and Tailoring of Macrolactamization in Syringolin Biosynthesis
American Chemical Society | 2011| -
Small-Angle X‑ray Scattering Curves of Detergent Micelles: Effects of Asymmetry, Shape Fluctuations, Disorder, and Atomic Details
American Chemical Society | 2020| -
Surface-Initiated Polymerization within Mesoporous Silica Spheres for the Modular Design of Charge-Neutral Polymer Particles
American Chemical Society | 2014| -
Kinetic Acidity of Supramolecular Imidazolium SaltsEffects of Substituent, Preorientation, and Counterions on H/D Exchange Rates
American Chemical Society | 2006| -
Single Hair Analysis of Small Molecules Using MALDI-Triple Quadrupole MS Imaging and LC-MS/MS: Investigations on Opportunities and Pitfalls
American Chemical Society | 2014| -
Temperature-Dependent Thermal and Elastic Properties of the Interlamellar Phase of Semicrystalline Polyethylene by Molecular Simulation
American Chemical Society | 2006| -
Solvent-Extractable Polycyclic Aromatic Hydrocarbons in Biochar: Influence of Pyrolysis Temperature and Feedstock
American Chemical Society | 2012| -
Preparation of Heterobimetallic Ketimido-Actinide-Molybdenum Complexes
American Chemical Society | 2019| -
Measuring Aerosol Phase Changes and Hygroscopicity with a Microresonator Mass Sensor
American Chemical Society | 2018| -
Effect of Tribolayer Formation on Corrosion of CoCrMo Alloys Investigated Using Scanning Electrochemical Microscopy
American Chemical Society | 2013| -
Reversible Light‑, Thermo‑, and Mechano-Responsive Elastomeric Polymer Opal Films
American Chemical Society | 2013| -
Effect of Phytase on in Vitro Hydrolysis of Phytate and the Formation of myo-Inositol Phosphate Esters in Various Feed Materials
American Chemical Society | 2019| -
Validation and Application of an Improved Method for the Rapid Determination of Proline in Grape Berries
American Chemical Society | 2014| -
Mussel-Inspired Injectable Hydrogel Adhesive Formed under Mild Conditions Features Near-Native Tissue Properties
American Chemical Society | 2019| -
The Catalytic Reaction of Nitroxides with Peroxyl Radicals and Its Relevance to Their Cytoprotective Properties
American Chemical Society | 2018| -
Total Synthesis of Acanthodoral Using a Rearrangement Strategy
Free accessAmerican Chemical Society | 2024| -
Ultrasensitive Tip- and Antenna-Enhanced Infrared Nanoscopy of Protein Complexes
American Chemical Society | 2019| -
Auration, Argentation, and Mercuration Reactions of an Iridaphosphirene
American Chemical Society | 2005| -
AknK Is an l-2-Deoxyfucosyltransferase in the Biosynthesis of the Anthracycline Aclacinomycin A †
American Chemical Society | 2004| -
Prokaryotic Ubiquitin-like Protein (Pup) Is Coupled to Substrates via the Side Chain of Its C-Terminal Glutamate
American Chemical Society | 2010| -
Borane-Bridged Ruthenium Complex Bearing a PNP Ligand: Synthesis and Structural Characterization
American Chemical Society | 2015| -
Clickable Poly(2-oxazoline) Architectures for the Fabrication of Low-Fouling Polymer Capsules
American Chemical Society | 2013| -
NMR Structure Determination of a Segmentally Labeled Glycoprotein Using in Vitro Glycosylation
American Chemical Society | 2009|
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