Vol. 73, 12/2019: Artificial Intelligence in Swiss Chemical Research

Dr. Torsten Luksch, PD Dr. Hans Peter Lüthi
0969 | PDF | Editorial
Table of Contents
0970 | PDF | Table of Contents
Machine Learning at the Atomic Scale
F. Musil, M. Ceriotti*
0972 | Online Article | Scientific Articles
Quantum Chemistry Meets Machine Learning
A. Fabrizio, B. Meyer, R. Fabregat, C. Corminboeuf*
0983 | Online Article | Scientific Articles
Exploring Machine Learning Tools for the Prediction of the Stability of New Togni-type Reagents
S. Koichi*, H. P. Lüthi*
0990 | Online Article | Scientific Articles
Data-driven Chemical Reaction Prediction and Retrosynthesis
V. H Nair, P. Schwaller, T. Laino*
0997 | Online Article | Scientific Articles
Reducing the Concepts of Data Science and Machine Learning to Tools for the Bench Chemist
R. A. Lewis*, P. Ertl, N. Schneider, N. Stiefl
1001 | Online Article | Scientific Articles
De novo Molecular Design with Generative Long Short-term Memory
F. Grisoni, G. Schneider*
1006 | Online Article | Scientific Articles
Pharmacoepidemiology and Big Data Analytics: Challenges and Opportunities when Moving towards Precision Medicine
A. M. Burden
1012 | Online Article | Scientific Articles
Exploring Chemical Space with Machine Learning
J. Arús-Pous, M. Awale, D. Probst, J.-L. Reymond*
1018 | Online Article | Scientific Articles
Machine Learning with and for Molecular Dynamics Simulations
S. Riniker*, S. Wang, P. Bleiziffer, L. Böselt, C. Esposito
1024 | Online Article | Scientific Articles
Operator Quantum Machine Learning: Navigating the Chemical Space of Response Properties
A. S. Christensen, O. A. von Lilienfeld*
1028 | Online Article | Scientific Articles
Swiss Science Concentrates
1032 | PDF | Column: Swiss Science Concentrates
SU-8 Micropipettes for Gentle Single-cell Manipulation
V. Martinez, H. Han, J. Vörös, T. Zambelli*
1033 | PDF | Column: Highlights of Analytical Sciences in Switzerland
Polymer–Nanoparticle Hydrogels
S. Bernhard, G. Bovone, E. A. Guzzi, M. W. Tibbitt*
1034 | PDF | Column: Polymer and Colloid Highlights
Phosphorus – Friend of the Medicinal Chemist
J. Hall
1035 | PDF | Column: Medicinal Chemistry and Chemical Biology Highlights
The Sting’s the Thing
C. E. Housecroft
1037 | PDF | Column: Chemical Education
Microparticles as Additives for Increasing the Mechanical Stiffness of Polypropylene
S. Hengsberger*, G. Leignel, E. Véron du Breuil, C. Cotting, R. Meuwly, J. Dutoit, T. Chappuis*
1039 | PDF | Column: Universities of Applied Sciences (FH-HES)
Chirality@The Nanoscale, Symposium Congresso Stefano Franscini (CSF), Monte Verita, Ascona, 13–17 October, 2019
K.-H. Ernst
1042 | PDF | Columns, Conference Reports
Community News
1044 | PDF | Community News, Events, Reports
Congresses, Symposia, Lectures, Education Courses
1050 | PDF | News & Events
Impressum & Index
1055 | PDF | Miscellaneous
Further Education in Chemical Analysis : Course Program 2020
1063 | PDF | News & Events
Firmen stellen sich und ihre Produkte vor
1064 | PDF | Chimia Report