Computational Chemistry Highlights: June 2017
Sixty-Four Free Chemistry Databases | Depth-First
Spartan (chemistry software) - Wikipedia
Computational chemistry - Wikipedia
Sixty-Four Free Chemistry Databases | Depth-First
QM-sym, a symmetrized quantum chemistry database of 135 kilo molecules | Scientific Data
Software – Oleksandr V. Savytskyi, PhD
PCCDB Project
CCCBDB introduction navigation
ChemAlive Database $10,000 for 134,000 Molecules by Peter Damian Jarowski — Kickstarter
Diversifying databases of metal organic frameworks for high-throughput computational screening | Theoretical and Computational Chemistry | ChemRxiv | Cambridge Open Engage
Quantum Chemistry in the Age of Machine Learning | The Journal of Physical Chemistry Letters
Course 1: Introduction
Deep integration of machine learning into computational chemistry and materials science | Semantic Scholar
Evolution of the research workflow in computational chemistry from... | Download Scientific Diagram
Quantum Chemistry Common Driver and Databases (QCDB) and Quantum Chemistry Engine (QCEngine): Automation and interoperability among computational chemistry programs: The Journal of Chemical Physics: Vol 155, No 20
Construction of a robust, large-scale, collaborative database for raw data in computational chemistry: the Collaborative Chemistry Database Tool (CCDBT). | Semantic Scholar
What does CCCBDB mean? - Definition of CCCBDB - CCCBDB stands for Computational Chemistry Comparison and Benchmark Database. By AcronymsAndSlang.com
The MolSSI QCArchive
Sixty-Four Free Chemistry Databases | Depth-First
Evolution of the research workflow in computational chemistry. The... | Download Scientific Diagram
Construction of a robust, large-scale, collaborative database for raw data in computational chemistry: The Collaborative Chemistry Database Tool (CCDBT) - ScienceDirect
Broombridge Quantum Chemistry Schema - Azure Quantum | Microsoft Docs
Managing the Computational Chemistry Big Data Problem: The ioChem-BD Platform | Journal of Chemical Information and Modeling
Perspective: Computational chemistry software and its advancement as illustrated through three grand challenge cases for molecular science: The Journal of Chemical Physics: Vol 149, No 18
