tlooto
Sign up
Computer ScienceChemistry

AMBER, a package of computer programs for applying molecular mechanics, normal mode analysis, molecular dynamics and free energy calculations to simulate the structural and energetic properties of molecules

D. Pearlman, D. Case, J. Caldwell, W. Ross, T. Cheatham, S. DeBolt, D. Ferguson, G. Seibel, P. Kollman

1995.9.2COMPUTER PHYSICS COMMUNICATIONS

DOI: 10.1016/0010-4655(95)00041-d

tlooto Summary

The development, current features, and some directions for future development of the AMBER package of computer programs are described, embodying a number of the powerful tools of modern computational chemistry-molecular dynamics and free energy calculations.

Abstract

Abstract is not available.

Citation format

PEARLMAN, D., et al. AMBER, a package of computer programs for applying molecular mechanics, normal mode analysis, molecular dynamics and free energy calculations to simulate the structural and energetic properties of molecules. COMPUTER PHYSICS COMMUNICATIONS, 1995, 91: 1–41.