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"RasMol & Chime: Molecular Visualization Freeware"

"RasMol & Chime: Molecular Visualization Freeware"

3DChem.com - Chemistry, Structures, and 3D Molecules

A collection of interactive 3D animations and structures for chemistry students and teachers, provided by the University of Liverpool.

Avogadro: Advanced Molecular Editor

An advanced molecule editor and visualizer designed for cross-platform use in computational chemistry, molecular modeling, bioinformatics, and materials science.

Banque de molélcules et d"ions ne contenant pas d"élélments de transition

Banque de molélcules et d"ions ne contenant pas d"élélments de transition

BioMolecular Explorer 3D

BioMolecular Explorer 3D

Center for Molecular Modeling (CMM) | NIH

The CMM provides collaborative research and consultation in computational chemistry and molecular modeling to the National Institutes of Health (NIH) intramural research community.

Chemie in vier Dimensionen

Chemie in vier Dimensionen

ChemSpider - The free chemical database

A free chemical structure database providing fast search access to over 100 million structures from hundreds of data sources. Provided by the Royal Society of Chemistry.

Chime Resources

Chime Resources

Chmoogle

Chmoogle

Cochranes of Oxford Ltd

Equipos educativos de ciencia.

Computational Chemistry - Wikibooks

An open-content textbook on computational chemistry, covering topics from molecular mechanics to ab initio methods. A collaborative resource for students and researchers.

Drug Discovery Solutions - Clarivate

Inteligencia en descubrimiento de fármacos.

DrugBank Online

A comprehensive, freely accessible, online database containing information on drugs and drug targets. A key bioinformatics and cheminformatics resource.

ExPASy

ExPASy

GAMESS-UK

Software de química computacional.

Gaussian Support

Soporte oficial de Gaussian.

Ghemical paper

Referencia científica.

gOpenMol

Visualización de estructuras.

HyperChem Support

Soporte de HyperChem.

Indiana University Molecular Structure Center

Indiana University Molecular Structure Center

Indigo Instruments

Indigo Instruments

Jmol and JSmol: An open-source HTML5/Java viewer for chemical structures

JSmol is a JavaScript-based molecular viewer that runs in any modern web browser, enabling the display of molecules, crystals, and biomolecules without plugins.

MacroModel

MacroModel

MathMol - Mathematics and Molecules K-12

An NSF-funded project at New York University (NYU) to develop instructional materials and activities for K-12 students, integrating molecular modeling and mathematics.

MathMol Library of 3-D Molecular Structures

A library of molecular structures provided by the MathMol K-12 project at New York University (NYU), designed for educational use.

MathMol Library of 3-D Molecular Structures

A library of molecular structures provided by the MathMol K-12 project at New York University (NYU), designed for educational use.

Molecular Modeling of Inorganic Compounds, 3rd Edition

The official publisher page for the textbook by Peter Comba, et al., a key resource for learning the theory and application of molecular modeling to inorganic systems.

Molecule of the Month

Molecule of the Month

Molecule of the Month - PDB-101

An educational resource from RCSB PDB that presents a new molecule each month, providing a detailed structural overview.

Molecule of the Month - University of Bristol

A long-running educational website featuring a different molecule each month, with information about its properties, uses, and chemical significance.

Molecule Shapes - PhET Interactive Simulations

Explore molecule shapes by building molecules in 3D! See how molecule geometry changes with different numbers of bonds and lone pairs. From the University of Colorado Boulder.

MolView

An intuitive, open-source web application for molecular viewing and chemical structure editing that runs in any modern web browser.

NCBI Structure Database (MMDB)

The Molecular Modeling Database (MMDB) from NIH contains experimentally determined 3D biomolecular structures. It provides tools for searching and visualization.

OpenMolcas - Computational Chemistry Software

The official homepage for OpenMolcas, a quantum chemistry software package developed by scientists. It is used to study the electronic structure of molecules.

ORBKIT: A Modular Python Toolbox for Post-Processing Quantum Chemical Calculations

An open-source Python program for post-processing quantum chemistry calculations. It is particularly useful for analyzing and visualizing molecular orbitals.

PubChem

PubChem is the world"s largest collection of freely accessible chemical information. Search chemicals by name, molecular formula, structure, and other identifiers.

RCSB PDB: Research Collaboratory for Structural Bioinformatics PDB

Users can perform simple and advanced searches based on annotations relating to sequence, structure and function. These molecules are visualized, downloaded, and analyzed by users who range from students to specialized scientists.

SIRCh: Molecular Visualization Tools and Sites

SIRCh: Molecular Visualization Tools and Sites

SMILES - A Simplified Chemical Language

Official information source for SMILES (Simplified Molecular Input Line Entry System) by Daylight Chemical Information Systems, Inc.

SMILES Theory Manual

Official Daylight tutorials and theory manual for the SMILES chemical notation system.

The QSAR and Modelling Society

The QSAR and Modelling Society

Theory Manual

Theory Manual

UCSF ChimeraX

Next-generation molecular visualization program from the UCSF Resource for Biocomputing, Visualization, and Informatics for interactive analysis of molecular structures.

Visualization article

Publicación científica.

VMD - Visual Molecular Dynamics

A molecular visualization program for displaying, animating, and analyzing large biomolecular systems using 3-D graphics and built-in scripting. Developed at UIUC.

WebMO - Web-Based Interface to Computational Chemistry

A web-based interface for computational chemistry programs. Allows users to build molecules, run calculations, and visualize results, including vibrational frequencies.

YASARA - Yet Another Scientific Artificial Reality Application

YASARA - Yet Another Scientific Artificial Reality Application




 


 


 






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