Tripos SYBYL-X 2.1.1 Win/Mac/Lnx

SYBYL套装软体，Tripos出品的专业分子模拟平台，涵盖了分子模拟与显示、定量构效关係和ADME、药效团模型、生物资讯学、基於结构的药物设计、化学资讯学和数据库、组合化学和分子多样性、NMR数据处理、化合物实体提供等多种与药物研究和开发相关的方向，为用户提供全面的药物设计和生物化学研究的解决方案。
Sybyl是Tripos公司专门为药物小分子与生物大分子科学领域研究者所设计分子模拟软体。模拟的内容包括了药物小分子的建模、构象分析、三维定量构效关係研究、药效团建模、虚拟筛选、生物大分子的同源模建、活性位点分析、数据库搜索等。
SYBYL软件包，Tripos出品的专业分子模拟平台，涵盖了分子模拟与显示、定量构效关系和ADME、药效团模型、生物信息学、基于结构的药物设计、化学信息学和数据库、组合化学和分子多样性、NMR数据处理、化合物实体提供等多种与药物研究和开发相关的方向，为用户提供全面的药物设计和生物化学研究的解决方案。
Tripos SYBYL-X 2.1.1 (Win/Mac/Lnx) | 851/616/835 MB
Whether you need to find new lead candidates, optimize lead series, or perform other related life science experiments like modeling a protein structure, SYBYL?-X has solutions to move your discovery research forward. With capabilities for small molecule modeling and simulation, macromolecular modeling and simulation, cheminformatics, lead identification, and lead optimization, all wrapped up in an easy to use, cost-effective interface, SYBYL-X has the tools and capabilities you need for molecular design.
Additionally, the science offered by SYBYL-X provides unique, competitive advantages in a number of areas vital for today's successful discovery research:
3D QSAR: use the power of industry leading CoMFA in a new way to generate novel ideas for R-groups – predict the level of biological activity or potency based on structure-activity data, not just yes/no activity predictions
Ligand-based virtual screening: search millions of compounds overnight — don’t miss hits because you only screened subsetted portions of your database
Cheminformatics: produce highly focused queries that avoid false positives using rich set of 3D queries; on-the-fly conformational searching means you only store a single conformation of your molecules, keeping database size small and very transportable
Docking: custom tailor and fine-tune docking to a particular receptor site using information like SAR or known poses to improve rank ordering of ligands.