Molecular Docking Web (Popularity: )

Protein-ligand Docking, structures, bioinformatics, computational chemistry, and drug design resources.

Computational Chemistry List (Popularity: )

A resource for computational chemists. Discussions on chemistry software, data, conferences, jobs, quantum chemistry, molecular ...

Computational Chemistry and Organic Synthesis (Popularity: )

A tutorial intended for experimental organic chemists, with emphasis on computational methods for locating and ...

Molecular Modeling for Organic Chemistry (Popularity: )

Summary of lecture course which aims to introduce the hierarchy of computational modeling methods used ...

MathMol (Popularity: )

Provides students, teachers and researchers the basic concepts in mathematics and their connection to molecular ...

Computational Chemistry Resources (Popularity: )

Directory of links related to computational chemistry. Offers several tutorials for understanding the basics of ...

Australian Computational Chemistry Via the Internet Project (Popularity: )

A set of web-based teaching modules.

Computational Chemistry Comparison and Benchmark Database (Popularity: )

Database of molecules with well established heat of formation, no atoms with atomic number greater ...

Cambridge University Silicon Graphics Teaching Laboratory (Popularity: )

An outline of a course in computational chemistry. Includes exercises in conformational search, molecular dynamics, ...

CMM (Popularity: )

Center for Molecular Modeling: Several tutorials related to molecular modeling, directory of software and links ...

Molecular Modeling (Popularity: )

Links to information on chemical structures, graphics, slide shows, and modeling experiments.

Virtual Computational Chemistry Laboratory (Popularity: )

Provides interactive on-line calculation of physico-chemical properties (logP, aqueous solubility), molecular descriptors (E-Dragon, fragmental and ...

First Principles Research, Inc. (Popularity: )

Research Theorists in Physics and Chemistry.

MatHub (Popularity: )

Features current and background information about molecular modeling and informatics for chemistry and materials science.

EPSRC National Service for Computational Chemistry Software (Popularity: )

Provides software, specialist consultation, computing resources, and software training to support UK academics. Directions, staff, ...