MOPAC2016™ 量子化學軟體-資安軟體/研究分析軟體/心理學軟體/新永資訊有限公司

MOPAC2016™ 量子化學軟體

MOPAC2016™ 量子化學軟體

  • MOPAC2016™ 量子化學軟體
  • 編號
  • 類別
    生化統計分析軟體
  • 介紹
    MOPAC2016™ is the successor to MOPAC2012™ and has improved methods for modeling large biomolecules. MOPAC2016™ is a semiempirical quantum chemistry software package for the prediction of chemical properties and modeling of chemical reactions. It is used by chemists and biochemists for both research and teaching, and runs on Windows®, Linux, and Macintosh platforms.
  • 價格

MOPAC2009  量子化學軟體

MOPAC2009™ is the successor to a MOPAC2007™, a semiempirical quantum chemistry software package for the prediction of chemical properties and modeling of chemical reactions. It is used by chemists and biochemists for both research and teaching, and runs on Windows®, Linux and Macintosh platforms.
MOPAC2009™ is a completely updated and rewritten version based on the public domain MOPAC® 6 with many bug fixes and several major enhancements added, including the new PM6 method which was parameterized primarily for biochemistry.  MOPAC2009™ now includes a linear scaling algorithm for geometry optimizations on systems of up to 15,000 atoms such as proteins, metalloenzymes, and segments of DNA.
Technical:
• NEW, optimize giant molecules up to 15,000 atoms, e.g. proteins
• NEW PM6 parameterization using experimental and ab initio data
• More accurate* heats of formation and geometries
• ALL main group elements & transition metals parameterized
• Serious errors from PM3 and AM1 corrected
• Crystals, surfaces & polymers with periodic boundaries
• FREE to academics

MOPAC2016™ 量子化學軟體

MOPAC2016™ is the successor to MOPAC2012™ and has improved methods for modeling large biomolecules. MOPAC2016™ is a semiempirical quantum chemistry software package for the prediction of chemical properties and modeling of chemical reactions. It is used by chemists and biochemists for both research and teaching, and runs on Windows®, Linux, and Macintosh platforms.

Improved handling of large biomolecules. This includes the ability to more easily manipulate macromolecules, e.g., to ionize and de-ionize individual atoms and residues, superimposition and calculation of RMSD for pairs of systems, and easier specification of individual atoms.

Technical:
• Major improvements for crystals & condensed phase
• Fast optimizations up to 15,000 atoms, e.g. proteins
• New PM7 parameterization from experimental & ab initio
• More accurate H-bond and dispersion energies
• All main group elements & transition metals (83)
• FREE to academics

PQS ab initio 4.0 量子化學計算軟體

PQS ab initio PROGRAM is the quantum chemistry calculation software which completes the function where Hartree-Fock method and density functional method etc are well used. Good quality of parallel conversion efficiency and structural optimization routine with merit, can realize especially the high-speed characteristic in the calculation which it does as routine work such as property calculation and molecular structural search.

特價0

PQS ab initio 4.0 量子化學計算軟體
PQS ab initio 4.0 量子化學計算軟體

Diamond 4 分子結構軟體

Diamond是傑出的分子和晶體結構顯示軟體.它結合了多種功能,可以用於含有晶體結構數據的工作,適用於教育,科學研究以及出版。Diamond像其它的軟體一樣不僅可以畫出精密的分子和晶體結構圖片,它還有一系列拓展的功能,它可以讓你很容易的從一套基本結構參數(晶胞,空間群和原子的位置)中模擬任意部分的晶體結構。

特價0

Diamond 4 分子結構軟體
Diamond 4 分子結構軟體

ChemOffice version 19.0

Chemistry’s #1 choice for communicating. ChemDraw helps chemists be more efficient; communicate more clearly; and reach crucial information faster. No wonder over 1 million users (and growing) count on ChemDraw. It’s the chemically intelligent solution for R&D for publishing, presenting and reporting.

特價0

ChemOffice version 19.0
ChemOffice version 19.0

公司資訊

立即聯繫

透過以下方式迅速的聯絡我們

2018© Copyright All Rights Reserved

蘋果網頁設計
資安軟體量身規劃資訊安全零死角,提供有效方案,以期協助企業運用新科技改善及提升其商業服務及價值,資安軟體達到運用新科技最佳化商業營運及價值的目標。秉持讓客戶可以安心、輕鬆、有效的享用現代科技有線網路。資安軟體秉持讓客戶可以安心、輕鬆、有效的享用現代科技有線網路