Virtual Computational Chemistry Laboratory - Design and Description.
Igor V. TetkoJohann GasteigerRoberto TodeschiniAndrea MauriDavid J. LivingstonePeter ErtlVladimir A. PalyulinEugene V. RadchenkoNikolai S. ZefirovAlexander S. MakarenkoVsevolod Yu. TanchukVolodymyr V. ProkopenkoPublished in: J. Comput. Aided Mol. Des. (2005)
Keyphrases
- virtual laboratory
- case study
- virtual lab
- virtual world
- website
- engineering design
- design principles
- building blocks
- virtual reality
- computational chemistry
- machine learning
- life long learning
- optimal design
- design decisions
- software architecture
- design process
- low cost
- user interface
- information technology
- digital libraries
- multiscale
- high level
- computer vision
- genetic algorithm