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Evangelos A. Coutsias
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2020 – today
- 2023
- [c2]Xin Cao
, Mikhail Ignatov
Numerically stable algorithm for Inverse Kinematics of 6R problem and its applications to macrocycles. BCB 2023: 84:1 - 2021
- [j18]Mosavverul Hassan
Protein secondary structure motifs: A kinematic construction. J. Comput. Chem. 42(5): 271-292 (2021) - [j17]Mosavverul Hassan
Kinematic Reconstruction of Cyclic Peptides and Protein Backbones from Partial Data. J. Chem. Inf. Model. 61(10): 4975-5000 (2021) - 2020
- [j16]Sergei Kotelnikov, Andrey Alekseenko
Sampling and refinement protocols for template-based macrocycle docking: 2018 D3R Grand Challenge 4. J. Comput. Aided Mol. Des. 34(2): 179-189 (2020)
2010 – 2019
- 2019
- [j15]Evangelos A. Coutsias
RMSD and Symmetry. J. Comput. Chem. 40(15): 1496-1508 (2019) - 2018
- [j14]Michelle Hatch Hummel, Bihua Yu, Carlos Simmerling, Evangelos A. Coutsias
Laguerre-Intersection Method for Implicit Solvation. Int. J. Comput. Geom. Appl. 28(1): 1-38 (2018) - 2017
- [j13]Kevin Hauser, Yiqing He, Miguel Garcia-Diaz
Characterization of Biomolecular Helices and Their Complementarity Using Geometric Analysis. J. Chem. Inf. Model. 57(4): 864-874 (2017) - [i1]Michelle Hatch Hummel, Bihua Yu, Carlos Simmerling, Evangelos A. Coutsias:
Laguerre-Intersection Method for Implicit Solvation. CoRR abs/1712.06956 (2017) - 2016
- [j12]Robert H. Lewis, Evangelos A. Coutsias
Flexibility of Bricard's linkages and other structures via resultants and computer algebra. Math. Comput. Simul. 125: 152-167 (2016) - [j11]Gaurav Bhardwaj, Vikram Khipple Mulligan, Christopher D. Bahl
Accurate de novo design of hyperstable constrained peptides. Nat. 538(7625): 329-335 (2016) - 2015
- [j10]Evangelos A. Coutsias:
Bricard flexible octahedra and the canonical cyclohexane. ACM Commun. Comput. Algebra 49(2): 56 (2015) - 2011
- [j9]Junsu Ko, Dongseon Lee, Hahnbeom Park
The FALC-Loop web server for protein loop modeling. Nucleic Acids Res. 39(Web-Server-Issue): 210-214 (2011)
2000 – 2009
- 2008
- [j8]Sara N. Pollock
Scaffold Topologies. 1. Exhaustive Enumeration up to Eight Rings. J. Chem. Inf. Model. 48(7): 1304-1310 (2008) - [j7]Michael J. Wester
Scaffold Topologies. 2. Analysis of Chemical Databases. J. Chem. Inf. Model. 48(7): 1311-1324 (2008) - 2006
- [j6]Gregory von Winckel, Sanjay Krishna
Spectral element modeling of semiconductor heterostructures. Math. Comput. Model. 43(5-6): 582-591 (2006) - [c1]Robert H. Lewis, Evangelos A. Coutsias:
Algorithmic Search for Flexibility Using Resultants of Polynomial Systems. Automated Deduction in Geometry 2006: 68-79 - 2005
- [j5]Evangelos A. Coutsias
Rotational superposition and least squares: The SVD and quaternions approaches yield identical results. Reply to the preceding comment by G. Kneller. J. Comput. Chem. 26(15): 1663-1665 (2005) - 2004
- [j4]Evangelos A. Coutsias, Chaok Seok, Matthew P. Jacobson
A kinematic view of loop closure. J. Comput. Chem. 25(4): 510-528 (2004) - [j3]Evangelos A. Coutsias
Using quaternions to calculate RMSD. J. Comput. Chem. 25(15): 1849-1857 (2004)
1990 – 1999
- 1999
- [j2]David J. Torres, Evangelos A. Coutsias:
Pseudospectral Solution of the Two-Dimensional Navier-Stokes Equations in a Disk. SIAM J. Sci. Comput. 21(1): 378-403 (1999) - 1996
- [j1]Evangelos A. Coutsias
An efficient spectral method for ordinary differential equations with rational function coefficients. Math. Comput. 65(214): 611-635 (1996)
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