World Scientific - leading international publisher in medicine, science and technology.
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 is a refereed journal for scientific papers regarding all applications of molecular design
Enamine - smart chemistry solutions.
Compound libraries, Screening compounds, Fragment libraries, Fragments, Targeted Libraries, Focused Libraries, Building Blocks, New Chemical Entities, Active Intermediates, Hit-to-lead optimization, Custom synthesis, Custom Libraries, Computational Chemistry, Medicinal Chemistry, CRO, Custom Research Organizations
The goal of the conference is to bring together active researchers from the various disciplines to showcase their state-of-the-art research results and hopefully to forge new cross-disciplinary interactions among the participants. The conference provides a unique opportunity for in-depth technical discussions and...
FITTED - Fully automated flexible docking program and molecular modeling service company (expert consultant)
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.
PSSC Labs has delivered over 1500 High Performance Computing or HPC clusters, Linux clusters and clouds on high density, eco friendly and energy efficient platforms.
Cresset provide innovative software and services to Pharmaceutical, Biotech, Academic and other industries
Domainex is a drug discovery CRO with a reputation for speed and innovation built on an exceptional track record of drug candidate delivery. Its services include medicinal chemistry, computational chemistry, fragment-based hit screening, virtual screening, assay development and molecular biology These technologies...
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
Lanthanide Complexes Computational Chemistry | Sparkle Model for the calculation of coordination compounds of lanthanides
Scicasts is a data technology and media company that connects science professionals and decision makers to a dynamic network of critical information, new ideas and cross-sector intelligence.
Lead Finder is a software solution for virtual ligand screening and quantitative evaluation of interaction between protein and ligand molecules.
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,...
The aim of this is site is to present new or less known issues connected with computational chemistry (CC), rather than provide a guide. I hope that the site will develop along with me and become a valuable source of highly specialized knowledge in the future.
Innovative Informatica Technologies
Personal webpage for Yujie. Update technical blogs non-scheduledly.