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István Kolossváry
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2000 – 2009
- 2008
- [j9]David E. Shaw, Martin M. Deneroff, Ron O. Dror
, Jeffrey Kuskin, Richard H. Larson, John K. Salmon, Cliff Young, Brannon Batson, Kevin J. Bowers, Jack C. Chao, Michael P. Eastwood, Joseph Gagliardo, J. P. Grossman, C. Richard Ho, Doug Ierardi, István Kolossváry
Anton, a special-purpose machine for molecular dynamics simulation. Commun. ACM 51(7): 91-97 (2008) - 2007
- [c2]David E. Shaw, Martin M. Deneroff, Ron O. Dror
Anton, a special-purpose machine for molecular dynamics simulation. ISCA 2007: 1-12 - 2006
- [c1]Kevin J. Bowers, Edmond Chow, Huafeng Xu
Molecular dynamics - Scalable algorithms for molecular dynamics simulations on commodity clusters. SC 2006: 84 - 2002
- [j8]Olgun Guvench, Jörg Weiser, Peter S. Shenkin, István Kolossváry
Application of the frozen atom approximation to the GB/SA continuum model for solvation free energy. J. Comput. Chem. 23(2): 214-221 (2002) - 2001
- [j7]István Kolossváry, György M. Keserü
Hessian-free low-mode conformational search for large-scale protein loop optimization: application to c-jun N-terminal kinase JNK3. J. Comput. Chem. 22(1): 21-30 (2001)
1990 – 1999
- 1999
- [j6]István Kolossváry
On the Sign of Local Temperature in Molecules. Entropy 1(1): 4-8 (1999) - [j5]István Kolossváry, Wayne C. Guida:
Low-mode conformational search elucidated: Application to C39H80 and flexible docking of 9-deazaguanine inhibitors into PNP. J. Comput. Chem. 20(15): 1671-1684 (1999) - 1997
- [j4]Gábor I. Csonka
Simple tests for density functional methods. J. Comput. Chem. 18(12): 1534-1545 (1997) - 1996
- [j3]Attila Kovács, István Kolossváry, Gábor I. Csonka, István Hargittai:
Theoretical study of intramolecular hydrogen bonding and molecular geometry of 2-trifluoromethylphenol. J. Comput. Chem. 17(16): 1804-1819 (1996) - 1993
- [j2]István Kolossváry
Torsional flexing: Conformational searching of cyclic molecules in biased internal coordinate space. J. Comput. Chem. 14(6): 691-698 (1993) - 1992
- [j1]István Kolossváry
Compare Conformer: a program for the rapid comparison of molecular conformers based on interatomic distances and torsion angles. J. Chem. Inf. Comput. Sci. 32(3): 191-199 (1992)
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