Computational Chemistry Websites
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Home Page. Computational Chemistry List. Resource for Computational Chemists. Discussions on chemistry software, data, conferences, jobs, quantum chemistry, molecular mechanics, molecular dynamics, QSAR, molecular graphics, molecular modeling, and associated archives
Quantum Computational Software; Molecular Modeling; Visualization
Q-Chem: Chemistry software, theoretical chemistry and quantum Chemistry software for research, visualization, quantum calculation and molecular modeling
PrimeColor Software - freeware provider of such as CAESAR 1.0, CAESAR 2.0 and SAMOA 1.0, XT PRO, JFinder to study molecular structure, crystal structure, electronic structure and band structure
Provides freeware such as CAESAR 1.0, CAESAR 2.0, SAMOA 1.0, XT PRO, and JFinder as computational chemistry tools to study molecular structure, crystal structure, electronic structure and band structure.
Mulks Synthetic and Computational Chemistry Research
Florian Mulks is a German chemist currently working on reactive intermediates in organometallic reactions both experimentally and computationally.
Research | Vajda Lab | United States
Research in the Vajda Lab, also known as the Structural Bioinformatics Lab, headed by Sandor Vajda, focuses on the recognition of proteins and small molecules by protein receptors.
CECM Teaming for Excellence (2017-2018) — DIstributed Computing Environments (DICE) Team Website
Website of the Distributed Computing Environments research group - Krakow, Poland