DOCSLIB.ORG
Explore
Sign Up
Log In
Upload
Search
Home
» Tags
» Computational chemistry
Computational chemistry
Free and Open Source Software for Computational Chemistry Education
Computational Chemistry
NIST Computational Chemistry Comparison and Benchmark Database
UNE Postgraduate Conference 2017
Energy Technology and Management
Mathematical Chemistry! Is It? and If So, What Is It?
Path Optimization in Free Energy Calculations
Chapter Patterns of Curriculum Design
Managing the Computational Chemistry Big Data Problem: the Iochem-BD Platform M
Computational Chemistry As “Voodoo Quantum Mechanics”: Models, Parameterization, and Software
Combinatorial Chemistry Successful Strategies & Proof of Concept Case Studies
Computational Chemistry Software and Its Advancement As Illustrated Through Three Grand Challenge Cases for Molecular Science Anna Krylov, Theresa L
Understanding and Integrating Quantum Chemistry Byte by Byte
Computational Chemistry Database Prototype: Objectstore Judith Bayard Cushing, David Maier, Meenakshi Rao Oregon Graduate Instit
Haskell for Computational Quantum Chemistry
Recent Advances in the Application of Data Science and Machine/Deep Learning Methods to Research in Chemical and Biological Sciences : a Review
Simulation of Electronic Structure Hamiltonians Using Quantum Computers
Quantum Computing Activities and Their Impact on the ORNL Missions of Scientific Discovery and Energy Security
Top View
QUANTUM INFORMATION and COMPUTATION for CHEMISTRY 2016 Workshop Chairs Alán Aspuru-Guzik (Harvard University) Michael Wasielewski (Northwestern University)
Computational Quantum Chemistry of Chemical Kinetic Modeling
15-251 Great Ideas in Theoretical Computer Science Lecture 1: Introduction to the Course
Quantum Chemistry on Supercomputers
Quantum Chemistry in the Age of Quantum Computing Arxiv:1812.09976V2 [Quant-Ph] 28 Dec 2018
Developing a Computational Chemistry Framework for the Exascale Era
Introduction to Computational Chemistry Laboratory
Proquest Dissertations
Theory and Applications of Computational Chemistry the First Forty Years
Next-Generation Technologies in Computational Chemistry
Brief History of Computational Chemistry: Three Distinct Eras and the Relative Importance of Theoretical Insights and Computing Power in Advancing the Field
Reduction of the Molecular Hamiltonian Matrix Using Quantum Community Detection Susan M
Using Computational Chemistry to Understand & Discover Chemical Reactions
Computational Chemistry in the Cloud
“Only the Initiates Will Have the Secrets Revealed”: Computational Chemists and the Openness of Scientific Software Abstract
ACCDB: a Collection of Chemistry Databases for Broad Computational Purposes
Computational Medicinal Chemistry: a Useful Tool for Pharmaceutical Sciences and Drug Development
Structure and Ordering in Solvents and Solutions of Carbon Nanotubes
Basic Introduction of Computational Chemistry
Introduction to Computational Quantum Chemistry
Open Source Workflow Engine for Cheminformatics: from Data Curation to Data Analysis
Modern Computational Organic Chemistry Group Meeting
Computational Chemistry; Chemoinformatics; Computational Materials Science
Basic Idea of Combinatorial Chemistry Sudha M*
“Combinatorial Chemistry and the Grid” Chapter 42 in Grid Computing – Making the Global Infrastructure a Reality, F
Introduction to Computational Quantum Chemistry: Theory
Brief History of Computational Chemistry