Browse By Topic

Desktop Software

Bio3D	ChemBioOffice	Conference Review
BioAssay	ChemBioViz	E-Notebook
BioDraw	ChemDraw	Inventory
BioOffice	ChemDraw / Excel	MOPAC
BioViz	ChemNMR	SciStore.Com
Cameo	ChemOffice	Software Roundups
Chem3D	ChemSAR	Struct=Name
ChemBio3D	ChemScript	Textbook Roundups
ChemBioDraw	Chetah	Web Services
ChemBioFinder	CombiChem

Cloud Computing

BioAssay Cloud	E-Notebook Cloud	Registration Cloud
ChemBioOffice Cloud	Inventory Cloud

Workgroup Solutions

BioAssay Workgroup	E-Notebook Workgroup	Inventory Workgroup
ChemBioOffice Workgroup

Enterprise Solutions

21CFR11 Compliance	CombiChem Enterprise	LIMS
Analytical Chemistry	Connector for SAP	LimsLink
BioAssay Enterprise	DataMart	Manufacturing ELN / LIMS
Biology E-Notebook	DocManager Enterprise	Oracle Cartridge
BioSAR Enterprise	Drug Degradation	Process Chemistry and Data Management
ChemBioOffice Enterprise	E-Notebook Enterprise	Professional Services
ChemBioViz Enterprise	Ensemble Platform	Reaction Genius
Chemistry E-Notebook	Formulation & Analytical LIMS	Registration Enterprise
ChemOffice Enterprise	Formulations & Mixtures	Search Genius
ChemOffice WebServer	Inventory Enterprise	Trials Enterprise
ChemScript Enterprise	Labtronics

Scientific Databases

Adis R&D Insight	ChemSCX Database	Nanogen Index
Ashgate Drugs	Chiral Auxiliary	NCI & AIDS
ChemACX Database	Database Roundups	Off-Label Database
ChemBioFinder.Com	Drug Deg Database	Organic Syntheses
Chemical Catalogs	EH&S Enterprise	Pharmaceutical Excipients
Chemical Databases	Encyclopedia of Reagents for Organic Synthesis	Reaxys
ChemINDEX Database	LabEqwip	Sigma Aldrich MSDS
ChemInfo Database	Martindale for Scientists	The Merck Index
ChemInfo Database	MediChem Database	Traditional Chinese Medicines
ChemMSDX Database

Strategic Partners

Accenture	Fujitsu	Redasoft
ACD Labs	Gaussian	Rescentris
Acumenta	IBM	Schrödinger
Agilent Scientific Software	KNIME	Sigma-Aldrich
Axiope	LabTech	Spotfire
BioByte	LabVantage	StatSoft
BioPoint Solutions	Merck	Thermo Galactic
BioReason	Mestrelab Research	Tripos
CAChe	Microsoft	Waters NuGenesis
ChemBioConnect	Oracle	White Carbon
Cresset BioMolecular Discovery	Oriental Giken	Wolters Kluwer
Elsevier	Pfizer	Yet2.Com

Major Customers

Abbott Laboratories	Cambria Biosciences	MethylGene
Achillion	Cubist Pharmaceuticals	Millennium Pharmaceuticals
Addex	Emory University	Organon
Albany Molecular	Ensemble Discovery	Patent Office
Arena Pharmaceuticals	GlaxoSmithKline	Pfizer
Array BioPharma	Harvard Medical School	Philips Research
Asahi Glass	Infinity Pharmaceuticals	PrimerDesign
AstraZeneca	Korea United Pharmaceuticals	Rohm & Haas
BioCryst	Lubrizol	Sareum
BioSeek	MercaChem	Wyeth
Bristol-Myers Squibb	Merck

Conference and User Meetings

2001	2006	2009
2004	2007	2010
2005	2008	2011

Science Topics

Biomolecules	Polymers	Stereochemistry
Nomenclature	Spectroscopy	Tautomers

View All

Desktop Software

Bio3D	ChemBioDraw	ChemOffice	Inventory
BioAssay	ChemBioFinder	ChemSAR	MOPAC
BioDraw	ChemBioOffice	ChemScript	SciStore.Com
BioOffice	ChemBioViz	Chetah	Software Roundups
BioViz	ChemDraw	CombiChem	Struct=Name
Cameo	ChemDraw / Excel	Conference Review	Textbook Roundups
Chem3D	ChemNMR	E-Notebook	Web Services
ChemBio3D

Cloud Computing

BioAssay Cloud	E-Notebook Cloud	Inventory Cloud	Registration Cloud
ChemBioOffice Cloud

Workgroup Solutions

BioAssay Workgroup

ChemBioOffice Workgroup

E-Notebook Workgroup

Inventory Workgroup

Enterprise Solutions

21CFR11 Compliance	ChemOffice Enterprise	E-Notebook Enterprise	Manufacturing ELN / LIMS
Analytical Chemistry	ChemOffice WebServer	Ensemble Platform	Oracle Cartridge
BioAssay Enterprise	ChemScript Enterprise	Formulation & Analytical LIMS	Process Chemistry and Data Management
Biology E-Notebook	CombiChem Enterprise	Formulations & Mixtures	Professional Services
BioSAR Enterprise	Connector for SAP	Inventory Enterprise	Reaction Genius
ChemBioOffice Enterprise	DataMart	Labtronics	Registration Enterprise
ChemBioViz Enterprise	DocManager Enterprise	LIMS	Search Genius
Chemistry E-Notebook	Drug Degradation	LimsLink	Trials Enterprise

Scientific Databases

Adis R&D Insight	ChemInfo Database	EH&S Enterprise	Off-Label Database
Ashgate Drugs	ChemInfo Database	Encyclopedia of Reagents for Organic Synthesis	Organic Syntheses
ChemACX Database	ChemMSDX Database	LabEqwip	Pharmaceutical Excipients
ChemBioFinder.Com	ChemSCX Database	Martindale for Scientists	Reaxys
Chemical Catalogs	Chiral Auxiliary	MediChem Database	Sigma Aldrich MSDS
Chemical Databases	Database Roundups	Nanogen Index	The Merck Index
ChemINDEX Database	Drug Deg Database	NCI & AIDS	Traditional Chinese Medicines

Strategic Partners

Accenture	ChemBioConnect	Merck	Sigma-Aldrich
ACD Labs	Cresset BioMolecular Discovery	Mestrelab Research	Spotfire
Acumenta	Elsevier	Microsoft	StatSoft
Agilent Scientific Software	Fujitsu	Oracle	Thermo Galactic
Axiope	Gaussian	Oriental Giken	Tripos
BioByte	IBM	Pfizer	Waters NuGenesis
BioPoint Solutions	KNIME	Redasoft	White Carbon
BioReason	LabTech	Rescentris	Wolters Kluwer
CAChe	LabVantage	Schrödinger	Yet2.Com

Major Customers

Abbott Laboratories	BioCryst	Harvard Medical School	Organon
Achillion	BioSeek	Infinity Pharmaceuticals	Patent Office
Addex	Bristol-Myers Squibb	Korea United Pharmaceuticals	Pfizer
Albany Molecular	Cambria Biosciences	Lubrizol	Philips Research
Arena Pharmaceuticals	Cubist Pharmaceuticals	MercaChem	PrimerDesign
Array BioPharma	Emory University	Merck	Rohm & Haas
Asahi Glass	Ensemble Discovery	MethylGene	Sareum
AstraZeneca	GlaxoSmithKline	Millennium Pharmaceuticals	Wyeth

Conference and User Meetings

2001	2006	2008	2010
2004	2007	2009	2011
2005

Science Topics

Biomolecules	Polymers	Stereochemistry	Tautomers
Nomenclature	Spectroscopy

Spotlight

WEBINAR

The Genius of Scientific and Chemical Searching
Increasing demands for cross-disciplinary collaboration and decision making have ...
By: Phil McHale of PerkinElmer Informatics and Philip Skinner, Ph.D. of PerkinElmer Informatics
from Issue 22.2
ARTICLE

PerkinElmer Informatics Announces winner of 75th Anniversary T-shirt contest!
Love is the Answer.
By: Richard A. Stanton of PerkinElmer Informatics
from Issue 22.2
FEATURE CLIP

IR, UV/VIS, and NMR spectra predictions
ChemBio3D brings workstation-quality molecular graphics and rigorous computational ...
By: Jesse Gordon of PerkinElmer Informatics
from Issue 20.4
WHITE PAPER

Ensemble for Biology
E-Notebook
A strong collaborative approach combining systematic experimental input from biologists ...
By: Megean J. Schoenberg of PerkinElmer Informatics
from Issue 22.1

ChemBioNews Search:

Home > Categories > MOPAC

MOPAC

Select Issue: Select Media:

Showing 1 - 11 of 11
Predicting pKa values in Chem3D Predict acid dissociation constants via ChemBio3D's MOPAC computational chemistry interface. Jesse Gordon PerkinElmer Informatics 21.3
IR, UV/VIS, and NMR spectra predictions ChemBio3D brings workstation-quality molecular graphics and rigorous computational methods to your desktop. ... Jesse Gordon PerkinElmer Informatics 20.4
IR, UV/VIS, and NMR spectra predictions Chem3D predicts spectra via multiple computational chemistry packages. Those packages include MOPAC, GAMESS, ... Jesse Gordon PerkinElmer Informatics 20.3
Predicting bond angles via Energy Minimization (oleic acid in MMFF94) This video demonstrates using MMFF94 to predict oleic acid's bond angle, and compares MMFF94's predicted bond ... Jesse Gordon PerkinElmer Informatics 20.3
ChemBio3D Ultra 12.0 with GAMESS Interface A state of the art software that is designed for desktop molecular modeling of both small and large molecules Zia Farooq Khan The Islamia University 20.2
Finding pKa in ChemDraw and ChemBioFinder Values for pKa can be predicted or it can be looked up: ChemDraw's "Chemical ... Jesse Gordon PerkinElmer Informatics 20.1
MOPAC documentation and Chem3D online help Chem3D provides built-in searchable help for MOPAC, with references to MOPAC's full online documentation manual. ... Jesse Gordon PerkinElmer Informatics 19.3
Perception of Tautomerism: Recent Advances in Recognition and Searching of Mobile Groups in Chemical Structure Tautomers present an interesting problem for chemical search programs. They represent interchangeable structures ... Jerald J. Baronofsky, Ph.D. PerkinElmer Informatics 18.2
MOPAC 2007 with ChemBio3D Did you know that you can now use MOPAC 2007 with ChemBio3D? MOPAC2007 is a completely updated and ... Jesse Gordon PerkinElmer Informatics 18.2
Chem3D, MOPAC & ChemDraw Helpful tools for this chemistry professor Elizabeth M. Larson, Ph.D. Grand Canyon University 15.2
ChemOffice Ultra Chemistry, Biology & More William Jones Imperial College London 15.1
1

Browse By Topic

Spotlight

WEBINAR

ARTICLE

FEATURE CLIP

WHITE PAPER

MOPAC

Predicting pKa values in Chem3D Predict acid dissociation constants via ChemBio3D's MOPAC computational chemistry interface.

IR, UV/VIS, and NMR spectra predictions ChemBio3D brings workstation-quality molecular graphics and rigorous computational methods to your desktop. ...

IR, UV/VIS, and NMR spectra predictions Chem3D predicts spectra via multiple computational chemistry packages. Those packages include MOPAC, GAMESS, ...

Predicting bond angles via Energy Minimization (oleic acid in MMFF94) This video demonstrates using MMFF94 to predict oleic acid's bond angle, and compares MMFF94's predicted bond ...

ChemBio3D Ultra 12.0 with GAMESS Interface A state of the art software that is designed for desktop molecular modeling of both small and large molecules

Finding pKa in ChemDraw and ChemBioFinder Values for pKa can be predicted or it can be looked up: ChemDraw's "Chemical ...

MOPAC documentation and Chem3D online help Chem3D provides built-in searchable help for MOPAC, with references to MOPAC's full online documentation manual. ...

Perception of Tautomerism: Recent Advances in Recognition and Searching of Mobile Groups in Chemical Structure Tautomers present an interesting problem for chemical search programs. They represent interchangeable structures ...

MOPAC 2007 with ChemBio3D Did you know that you can now use MOPAC 2007 with ChemBio3D? MOPAC2007 is a completely updated and ...

Chem3D, MOPAC & ChemDraw Helpful tools for this chemistry professor

ChemOffice Ultra Chemistry, Biology & More

Predicting pKa values in Chem3D

Predict acid dissociation constants via ChemBio3D's MOPAC computational chemistry interface.

IR, UV/VIS, and NMR spectra predictions

ChemBio3D brings workstation-quality molecular graphics and rigorous computational methods to your desktop. ...

IR, UV/VIS, and NMR spectra predictions

Chem3D predicts spectra via multiple computational chemistry packages. Those packages include MOPAC, GAMESS, ...

Predicting bond angles via Energy Minimization (oleic acid in MMFF94)

This video demonstrates using MMFF94 to predict oleic acid's bond angle, and compares MMFF94's predicted bond ...

ChemBio3D Ultra 12.0 with GAMESS Interface

A state of the art software that is designed for desktop molecular modeling of both small and large molecules

Finding pKa in ChemDraw and ChemBioFinder

Values for pKa can be predicted or it can be looked up:

ChemDraw's "Chemical ...

MOPAC documentation and Chem3D online help

Chem3D provides built-in searchable help for MOPAC, with references to MOPAC's full online documentation manual. ...

Perception of Tautomerism: Recent Advances in Recognition and Searching of Mobile Groups in Chemical Structure

Tautomers present an interesting problem for chemical search programs. They represent interchangeable structures ...

MOPAC 2007 with ChemBio3D

Did you know that you can now use MOPAC 2007 with ChemBio3D?
MOPAC2007 is a completely updated and ...

Chem3D, MOPAC & ChemDraw

Helpful tools for this chemistry professor

ChemOffice Ultra

Chemistry, Biology & More