Computational Chemistry Websites
World Scientific
World Scientific - leading international publisher in medicine, science and technology.
CCL Home
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
Internet Electronic Journal of Molecular Design
Internet Electronic Journal of Molecular Design is a refereed journal for scientific papers regarding all applications of molecular design
Ross Walker, San Diego Supercomputer Center
Dr Ross Walker, Applications Scientist, Amber Developer, The Scripps Research Institute and San Diego Supercomputer Center.
MolTech Ltd: Downloads
Lead Finder is a software solution for virtual ligand screening and quantitative evaluation of interaction between protein and ligand molecules.
Parallel Quantum Solutions - Turnkey Computational Chemistry
Parallel Quantum Solutions, atomic structure calculation, parallel quantum calculation, turnkey computational chemistry linux cluster, parallel computing, molecular modeling, molecular modelling, abinitio, SCF, DFT, NMR, optimization, chemical shift, geometry, density fuctional, wave function, Hartree Fock, MP2, vibrat
Computational Chemistry of Complexes of Lanthanides | Lanthanide Compl
Lanthanide Complexes Computational Chemistry | Sparkle Model for the calculation of coordination compounds of lanthanides
Ovidiu Ivanciuc
Ovidiu Ivanciuc, machine learning, pattern recognition, cheminformatics, computational chemistry, bioinformatics, computational biology, SVM, support vector machines, SVMC, support vector machines classification, SVMR, support vector machines regression, kernel
PrimeColor Software - freeware provider of such as CAESAR 1.0, CAESAR
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.
Fitted.ca - Home
FITTED - Fully automated flexible docking program and molecular modeling service company (expert consultant)
Computational Organic Chemistry by Steven M. Bachrach
The supplemental website to Steven Bachrach's book Computational Organic Chemistry
Riparian Software - speed and accuracy for molecular modeling
Riparian Software targets the bottlenecks in computational chemistry, using physics, chemistry, math, experiment, and theory.
Drug Discovery Chemistry | April 1-4, 2024 | San Diego, CA
Focused on discovery & optimization challenges of small molecule drug candidates, Drug Discovery Chemistry is a dynamic event for medicinal chemists working in pharma & biotech
Molecular Dynamics Group
Research Group utilizing Molecular Dynamics Simulations
CECM Teaming for Excellence (2017-2018) — DIstributed Computing Enviro
Website of the Distributed Computing Environments research group - Krakow, Poland
Home | The Shamay Lab
Yosi Shamay lab for computational and cancer nanomedicine
Welcome to www.mprdllc.com - Research & Development
Research and development on contract basis for commercial and academic organizations.
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.
Kenyatta University - School of Pure and Applied Sciences
Kenyatta University(KU)school of pure applied sciences' mission is to provide high quality education based on modern scientific teaching and research techniques and to produce highly trained scientists in the various disciplines
CCL Home
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
ChemistAi - Free
Our commitment to excellence redefines the boundaries of scientific exploration. Explore the future of chemistry with us.