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GAMESS is a computational chemistry software program and stands for General Atomic and Molecular Electronic Structure System.The original Quantum Chemistry Program Exchange (QCPE) code of GAMESS split in 1981 and now the three version differ considerably:
Firefly, formerly named PC GAMESS, is an ab initio computational chemistry program for Intel-compatible x86, x86-64 processors based on GAMESS (US) sources. However, it has been mostly rewritten (60-70% of the code), especially in platform-specific parts (memory allocation, disk input/output, network), mathematic functions (e.g., matrix operations), and quantum chemistry methods (such as ...
Free open-source, GPL C++, Qt, extensible via Python modules BALL: Molecular dynamics MM NMR: LGPL open-source: Standalone program [7] Cn3D: Free open-source: Standalone program [8] In the NCBI C++ toolkit Coot: XRD: Free open-source: Gabedit: XRD MM: Free open-source: C [9] Jmol: Free open-source: Java (applet or standalone program) Transpiled ...
The GAMESS (US) software also provides a comprehensive bonding analysis technique based on the Quasi-Atomic Orbital (QUAO) analysis proposed by professor Klaus Ruedenberg. The QUAO analysis provides a quasi-atomical perspective of bonding molecular orbitals in molecules. These are oriented orbitals which show the bonding direction.
Download as PDF; Printable version; ... The following is a list of 3D animation software that have articles in Wikipedia. Title License Release date ... 2010 Carrara ...
Name Latest stable release Developer License Operating system or environment Construct Animate (software) 26 March 2024: Scirra Trialware: Web application
Adventure game: Windows: 2010 Future Games: The last game developed by Future Games. Alternativa: Adventure game: Windows: 2010 Centauri Production: Originally planned as a first game in video game series. ARMA 2: Operation Arrowhead: Tactical shooter: Windows: 2010 Bohemia Interactive: An expansion pack to ARMA 2. Be a King 2: Strategy video ...
MultiMSMS Plugin — caches MSMS calculations to speedup the animation of a sequence of frames; Interactive Essential Dynamics — Interactive visualization of essential dynamics; Mead Ionize — Improved version of autoionize for highly charged systems; Andriy Anishkin's VMD Scripts — Many useful VMD scripts for visualization and analysis