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{{Short description|Software company in Canada}}
{{Infobox Company
{{Infobox company
| company_name = Chemical Computing Group
| company_logo = [[Image:CCG_logo.png|Chemical Computing Group]]
| name = Chemical Computing Group
| logo = CCG Logo Square 20190318.png
| vector_logo =
| vector_logo =
| company_type = [[Private company|Private]] | genre =
| type = [[Private company|Private]]
| genre =
| foundation = <!-- this parameter modifies "Founded" -->
| foundation = <!-- this parameter modifies "Founded" -->
| founder =
| founder =
| location_city =
| location_city =
| location_country =
| location_country =
| location = [[Montreal]], [[Quebec|PQ]], [[Canada]]
| location = [[Montreal|Montreal, Quebec]], Canada
| origins =
| origins =
| key_people = Paul Labute, [[President]] and [[Chief Executive Officer|CEO]]
| key_people = Paul Labute - President, CEO
| area_served =
| area_served =
| industry = [[Cheminformatics]] and [[bioinformatics]] software
| industry = [[Cheminformatics]] and [[bioinformatics]] software
| products = [[#Products|MOE]]
| products = [[Molecular Operating Environment|MOE]], PSILO
| revenue =
| revenue =
| operating_income =
| operating_income =
| net_income =
| net_income =
| num_employees = 25+ (2007)
| num_employees = 30+
| parent =
| parent =
| divisions =
| divisions =
| subsid =
| subsid =
| owner =
| owner =
| company_slogan =
| slogan =
| homepage = [http://www.chemcomp.com www.chemcomp.com]
| homepage = {{URL|www.chemcomp.com}}
| dissolved =
| dissolved =
| footnotes =
| footnotes =
}}
}}


'''Chemical Computing Group''' is a [[software]] company specializing in research software for [[computational chemistry]], [[bioinformatics]], [[cheminformatics]], [[docking (molecular)|docking]], [[pharmacophore|pharmacophore searching]] and [[molecular dynamics|molecular simulation]]. The company's main customer base consists of [[pharmaceutical]] and [[biotechnology]] companies, as well as [[academia|academic]] research groups. It is a private company that was founded in 1994; it is based in [[Montreal]], [[Canada]]. Its main product, Molecular Operating Environment (MOE), is written in a self-contained programming system, the [[SVL|Scientific Vector Language]] [[SVL]].
'''Chemical Computing Group''' is a [[software]] company specializing in research software for [[computational chemistry]], [[bioinformatics]], [[cheminformatics]], [[docking (molecular)|docking]], [[pharmacophore|pharmacophore searching]] and [[molecular dynamics|molecular simulation]]. The company's main customer base consists of [[pharmaceutical]] and [[biotechnology]] companies, as well as [[academia|academic]] research groups. It is a private company that was founded in 1994; it is based in [[Montreal|Montreal, Quebec]], Canada. Its main product, Molecular Operating Environment (MOE), is written in a self-contained programming system, the [[Scientific Vector Language]] (SVL).


== Products ==
== Products ==
* ''Molecular Operating Environment'' (MOE)
* MOE (Molecular Operating Environment)<ref>[https://www.chemcomp.com/Products.htm MOE (Molecular Operating Environment)]</ref>
* ''PSILO''


MOE is a drug discovery software platform that integrates visualization, modeling, and simulations, as well as methodology development. MOE scientific applications are used by biologists, medicinal chemists and computational chemists in pharmaceutical, biotechnology and academic research. MOE runs on [[Microsoft Windows|Windows]], [[Linux]], [[Unix]], and [[MacOS|MAC OS X]].
== Other institutions developing software for [[computational chemistry]] ==

* [[Accelrys]]
Main application areas: Structure-Based Design, Fragment-Based Design, Pharmacophore Discovery, Medicinal Chemistry Applications, Biologics Applications, Protein and Antibody Modeling, Molecular Modeling and Simulations, Cheminformatics & QSAR
* [[Inte:Ligand]]

* [[OpenEye Scientific Software]]
* PSILO: A Protein Structure Database System<ref>[https://www.chemcomp.com/index.htm#release_psilo PSILO: A Protein Structure Database System]

</ref>

PSILO is a protein structure database system that provides a repository for macromolecular and protein-ligand structural information. It allows research organizations to track, register and search both experimental and computational macromolecular structural data. A web-browser interface facilitates the searching and accessing of public and private structural data.

==References==
<references responsive="0" />


==External links==
==External links==
* [http://www.chemcomp.com Chemical Computing Group official homepage]
* {{Official website|www.chemcomp.com}}
* [http://membership.acs.org/c/Comp/CCG/ccg.html Excellence Award for student posters at [[American_Chemical_Society|ACS]] National Meetings]
* [https://www.acscomp.org/awards/chemical-computing-group-excellence-award Excellence Award for student posters] at [[American Chemical Society|ACS]] National Meetings
* [http://www.macresearch.org/review_moe_molecular_operating_environment Review of MOE 2005.06]
* [https://web.archive.org/web/20070929030830/http://www.macresearch.org/review_moe_molecular_operating_environment Review of MOE 2005.06]
* [http://www.genengnews.com/articles/chitem.aspx?aid=1443 Molecular fingerprints in MOE]
* [http://www.genengnews.com/articles/chitem.aspx?aid=1443 Molecular fingerprints in MOE]
* Discussion of Binary QSAR: Jürgen Bajorath (2004), Chemoinformatics: Concepts, Methods, and Tools for Drug Discovery page 92 ISBN 978-1588292612
* Discussion of Binary QSAR: Jürgen Bajorath (2004), Chemoinformatics: Concepts, Methods, and Tools for Drug Discovery page 92 {{ISBN|978-1-58829-261-2}}

[[Category:Research support companies]]
[[Category:Research support companies]]
[[Category:Software companies of Canada]]
[[Category:Software companies of Canada]]
[[Category:Companies based in Montreal]]
[[Category:Companies based in Montreal]]
[[Category:Molecular modelling software]]

Latest revision as of 13:29, 3 December 2024

Chemical Computing Group
Company typePrivate
IndustryCheminformatics and bioinformatics software
HeadquartersMontreal, Quebec, Canada
Key people
Paul Labute - President, CEO
ProductsMOE, PSILO
Number of employees
30+
Websitewww.chemcomp.com

Chemical Computing Group is a software company specializing in research software for computational chemistry, bioinformatics, cheminformatics, docking, pharmacophore searching and molecular simulation. The company's main customer base consists of pharmaceutical and biotechnology companies, as well as academic research groups. It is a private company that was founded in 1994; it is based in Montreal, Quebec, Canada. Its main product, Molecular Operating Environment (MOE), is written in a self-contained programming system, the Scientific Vector Language (SVL).

Products

[edit]
  • MOE (Molecular Operating Environment)[1]

MOE is a drug discovery software platform that integrates visualization, modeling, and simulations, as well as methodology development. MOE scientific applications are used by biologists, medicinal chemists and computational chemists in pharmaceutical, biotechnology and academic research. MOE runs on Windows, Linux, Unix, and MAC OS X.

Main application areas: Structure-Based Design, Fragment-Based Design, Pharmacophore Discovery, Medicinal Chemistry Applications, Biologics Applications, Protein and Antibody Modeling, Molecular Modeling and Simulations, Cheminformatics & QSAR

  • PSILO: A Protein Structure Database System[2]

PSILO is a protein structure database system that provides a repository for macromolecular and protein-ligand structural information. It allows research organizations to track, register and search both experimental and computational macromolecular structural data. A web-browser interface facilitates the searching and accessing of public and private structural data.

References

[edit]
  1. ^ MOE (Molecular Operating Environment)
  2. ^ PSILO: A Protein Structure Database System
[edit]
  • Official website
  • Excellence Award for student posters at ACS National Meetings
  • Review of MOE 2005.06
  • Molecular fingerprints in MOE
  • Discussion of Binary QSAR: Jürgen Bajorath (2004), Chemoinformatics: Concepts, Methods, and Tools for Drug Discovery page 92 ISBN 978-1-58829-261-2