Computational chemistry is the branch of theoretical chemistry whose major goals are to create efficient computer programs that calculate the properties of molecules (such as total energy, dipole moment, vibrational frequencies) and to apply these programs to concrete chemical objects. It is also sometimes used to cover the areas of overlap between computer science and chemistry. Computational chemistry methods are being developed & utilized to quantitatively characterize molecular components & interactions at a local (ligand-receptor) scale. Deterministic and stochastic system process analysis & optimization techniques, are applied towards elucidation of larger network structures (interlinked signaling, regulatory & metabolic pathways). The latter process relies on interpretation of data from network perturbation experiments, that may include consideration of genetic perturbations, environmental perturbations and disease state. Meanwhile, a great deal of software development activity is being expended on the software firms' core computational chemistry programs. Indeed, new versions of many flagship software packages have just been released, and they & some entirely new programs are bringing new levels of capability, flexibility, speed & accuracy to the application of the technology.
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Address: 9885 Mesa Rim Road, Suite 101, San Diego, California 92121, USA
https://moleculardepot.com |
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Phone: +1-(858)-900-3210
Molecular Depot LLC specialize in the development of research tools and biochemicals. Our products include specialty bacterial culture media, antibodies & antigens, enzymes & proteins, chemical compou
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Address: 225 W Washington St., Suite 425, Chicago, Illinois 60606, USA
www.systat.com |
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Phone: +1-(312)-220-0060
SYSTAT Software Inc. is a developer of Specialized Scientific Software Products for Data Analysis, Technical Graphing, and Presentation. Our Systat 12 is a powerful and versatile statistical software
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SigmaStat |
SigmaPlot |
SigmaScan
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Address: 1301 Marina Village Parkway, Suite 320, Alameda, California 94501, USA
www.id-bs.com |
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Phone: +001-(510)-814-4900
ID Business Solutions Inc. provides advanced software solutions. Our software offers a single framework for data management across the drug discovery process, forming a complete solution that enables
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Address: 4771 Mangels Blvd, Fairfield, California 94534, USA
www.chemsw.com |
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Phone: +001-(707)-864-0845
ChemSW offers asset management software for laboratories. We offer chemical inventory maintenance & msds management software, general/organic/synthetic & analytical chemistry software, amphibian ecoto
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Address: P.O. Box 51977, Palo Alto, California 94303, USA
www.equbits.com |
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Phone: +001-(888)-318-3377
Equbits LLC provides SVM based predictive modeling solutions to drug discovery professionals. Our Equbits foresight is a software application that provides classification and regression modeling that
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Address: 80 S. Lake Ave., Ste. 650, Pasadena, California 91101, USA
www.paracel.com |
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Phone: +001-(626)-744-2000
Paracel, Inc. develops and delivers massively-parallel genetic data & text analysis systems for the genomics, pharmaceutical, agricultural, information services and government markets. Our new Genemat
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Address: 9330 Scranton Road, Suite 150, San Diego, California 92121, USA
www.natural-selection.com |
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Phone: +001-(858)-455-6449
Natural Selection, Inc. offers solutions for bioinformatics problems and defense & homeland security. We offer a suite of computational tools for small molecule lead discovery and optimization. Our Co
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Address: 100 Cambridge Park Drive, Cambridge, Massachusetts 02140, USA
www.cambridgesoft.com |
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Phone: +001-(617)-588-9100
CambridgeSoft Corporation supplies discovery, collaboration, and knowledge enterprise solutions, desktop software, scientific databases & consulting services to the pharmaceutical, biotechnology & che
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Address: 9 Bisbee Court, Suite D, Santa Fe, New Mexico 87508, USA
www.eyesopen.com |
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Phone: +001-(505)-473-7385
OpenEye Scientific Software, Inc. provides software to the pharmaceutical industry for molecular modeling and cheminformatics. Our toolkits are programming libraries for creating customized applicatio
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Address: 30 West 86th Street, New York, New York 10024-3600, USA
www.bio-balance.com |
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Phone: +001-(212)-769-3877
Bio Balance, Inc focuses on biotechnology and pharmaceutical discovery. We focus on biophysical description of the initial receptor response, which lead to improve pharmaceuticals and be an alternativ
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Address: 411 1st Avenue S., Suite 700, Seattle, Washington 98104, USA
www.teranode.com |
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Phone: +001-(206)-219-3000
Teranode Corp. offers next-wave technology solutions for research intelligence, collaboration, and laboratory automation in healthcare & life sciences. Our protocol modeler is a data & management desi
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Address: 522 University Ave. Unit 900, Toronto, Ontario M5G 1W7, Canada
www.blueprint.org |
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Phone: +001-(416)-596-8505
The Blueprint Initiative deals with resource for biomolecular data. We collect & distribute information, public databases and other software.
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