Computational Chemistry

Computational chemistry has become a useful way to investigate materials that are too difficult to find or too expensive to purchase. It also helps chemists make predictions before running the actual experiments so that they can be better prepared for making observations. Accuracy can always be improved with greater computational cost. Significant errors can present themselves in ab initio models comprising many electrons, due to the computational cost of full relativistic-inclusive methods. Other methods that are using in drug discovery are density functional methods, semi-empirical and empirical methods, molecular mechanics, methods of solids, chemical dynamics and molecular dynamics.The global market for computational medicine and drug discovery software was estimated to be $5.2 billion in 2015 and is projected to escalate to $7.1 billion by 2021.

  • Theoretical chemistry
  • Interpreting molecular wave functions
  • Computational Methods
  • Computational Accuracy
  • Molecular mechanics.
  • Chemical dynamics.

Related Conference of Computational Chemistry

February 28-March 01, 2019 |

Global Pharmaceutical and Pharma Industry Conference

Osaka, Japan
March 18-19, 2019

13th International Conference on Biosimilars and Biologics

Amsterdam | Netherlands
July 26-27, 2019

13th Asian Biologics and Biosimilars Congress

Mercure Albert Park | Melbourne, Australia

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