Walter Thiel
发表
Ahmet Altun,
Sason Shaik,
Walter Thiel,
2006,
J. Comput. Chem..
Walter Thiel,
Serguei Patchkovskii,
1999,
J. Comput. Chem..
Jingjing Zheng,
Ahmet Altun,
Walter Thiel,
2007,
J. Comput. Chem..
Walter Thiel,
Daron Green,
Ian Boston,
1995,
HPCN Europe.
Walter Thiel,
Matthias Kolb,
W. Thiel,
1993,
J. Comput. Chem..
Walter Thiel,
Jeaphianne P. M. van Rijn,
Andrés M. Escorcia,
2019,
J. Comput. Chem..
Christian H. Bischof,
Bruno Lang,
Walter Thiel,
2005,
Future Gener. Comput. Syst..
Walter Thiel,
Lianghu Gu,
Yiying Zheng,
2017
.
Fred A. Hamprecht,
Walter Thiel,
Wilfred F. van Gunsteren,
2001
.
Walter Thiel,
2009
.
Walter Thiel,
Alexander Heinz,
2012
.
Walter Thiel,
Tatiana Vasilevskaya,
Maria G. Khrenova,
2016,
J. Comput. Chem..
Walter Thiel,
Lianghu Gu,
Yiying Zheng,
2017
.
Walter Thiel,
Tatiana Vasilevskaya,
Maria G. Khrenova,
2015,
J. Comput. Chem..
Walter Thiel,
Lianghu Gu,
Yiying Zheng,
2017
.
You Lu,
Walter Thiel,
Zhenggang Lan,
2012,
J. Comput. Chem..
Timothy Clark,
Paul von Ragué Schleyer,
Walter Thiel,
2003,
J. Comput. Chem..
Walter Thiel,
Elsa Sanchez-Garcia,
Markus Doerr,
2010,
J. Comput. Chem..
Walter Thiel,
Lianghu Gu,
Yiying Zheng,
2017
.
Bernard R Brooks,
Walter Thiel,
Gerhard König,
2018,
Molecular simulation.
Xin Wu,
Walter Thiel,
Axel Koslowski,
2016
.
Xin Wu,
Walter Thiel,
Pavlo O. Dral,
2018,
J. Comput. Chem..
Peter Willett,
Walter Thiel,
Modesto Orozco,
2014
.
Walter Thiel,
Claudia Loerbroks,
Andreas Heimermann,
2015,
J. Comput. Chem..
Walter Thiel,
Serguei Patchkovskii,
Axel Koslowski,
2005
.
Cyclization of an α,β‐Unsaturated hydrazone catalyzed by a BINOL‐phosphoric acid: Pericyclic or not?
Walter Thiel,
Berit Heggen,
Mahendra Patil,
2016,
J. Comput. Chem..
Xin Wu,
Walter Thiel,
Axel Koslowski,
2012,
Journal of chemical theory and computation.
Walter Thiel,
Lianghu Gu,
Yiying Zheng,
2017
.
Fred A. Hamprecht,
Walter Thiel,
Wilfred F. van Gunsteren,
2002,
J. Chem. Inf. Comput. Sci..
Walter Thiel,
Stephan P.A. Sauer,
Henrik F. Pitzner-Frydendahl,
2015
.
Walter Thiel,
Christel M. Marian,
Markus Doerr,
2010,
J. Comput. Chem..
Walter Thiel,
Serguei Patchkovskii,
1996,
J. Comput. Chem..
Peter Willett,
Walter Thiel,
Peter R. Schreiner,
2014
.
Walter Thiel,
Rong-Zhen Liao,
W. Thiel,
2013,
J. Comput. Chem..
Walter Thiel,
Alexander Heinz,
2015
.
Bernard R. Brooks,
Juyong Lee,
Walter Thiel,
2016,
Journal of Computer-Aided Molecular Design.
Walter Thiel,
Lianghu Gu,
Yiying Zheng,
2017
.
Walter Thiel,
Hans Martin Senn,
Paul Sherwood,
2007,
Journal of chemical theory and computation.
Walter Thiel,
Lianghu Gu,
Yiying Zheng,
2017
.
Walter Thiel,
Johannes Kästner,
W. Thiel,
2006,
The Journal of chemical physics.
Walter Thiel,
Gui-Juan Cheng,
Jeaphianne P. M. van Rijn,
2018,
J. Comput. Chem..
Walter Thiel,
Johannes Kästner,
W. Thiel,
2005,
The Journal of chemical physics.
Walter Thiel,
Bernd Engels,
Johannes Kästner,
2013,
Journal of chemical theory and computation.
Walter Thiel,
Lianghu Gu,
Yiying Zheng,
2017
.
Walter Thiel,
Pavlo O. Dral,
Pavlo O Dral,
2017,
The Journal of chemical physics.
Walter Thiel,
Dirk Bakowies,
1996,
J. Comput. Chem..
Walter Thiel,
Wilfred F. van Gunsteren,
Katharina Meier,
2012,
J. Comput. Chem..
Walter Thiel,
Adam Walters,
Marcel Bogey,
2000
.
Walter Thiel,
Pavlo O. Dral,
O. Anatole von
Lilienfeld,
2015,
Journal of chemical theory and computation.
Walter Thiel,
Thomas Howe,
Andrea Schuster,
2013
.
Walter Thiel,
Marco Bocola,
Nikolaj Otte,
2009,
J. Comput. Chem..
Walter Thiel,
Matthias Kolb,
W. Thiel,
1993,
J. Comput. Chem..
Walter Thiel,
Lianghu Gu,
Yiying Zheng,
2017
.
Walter Thiel,
Michael E. Beck,
Axel Koslowski,
2003,
J. Comput. Chem..
Walter Thiel,
Gerhard Hummer,
G. Hummer,
2013,
Nature.
Walter Thiel,
Michael Filatov,
W. Thiel,
2016,
Topics in current chemistry.
Walter Thiel,
Michael Bühl,
Dirk Bakowies,
1995
.
Walter Thiel,
Manfred T Reetz,
Iakov Polyak,
2013,
The journal of physical chemistry. B.
Walter Thiel,
Hans Martin Senn,
H. Senn,
2009,
Angewandte Chemie.
Walter Thiel,
Michael Filatov,
W. Thiel,
2015,
The journal of physical chemistry letters.
Walter Thiel,
Hai Lin,
Soroosh Pezeshki,
2013,
Journal of chemical theory and computation.
Walter Thiel,
Stefan Schröder,
1986
.
Walter Thiel,
A. Fu,
W. Thiel,
2006
.
Sason Shaik,
Walter Thiel,
Devesh Kumar,
2003,
Journal of the American Chemical Society.
Walter Thiel,
Mario Barbatti,
Oliver Weingart,
2013,
Journal of chemical theory and computation.
Sason Shaik,
Walter Thiel,
Hai Lin,
2002,
Journal of the American Chemical Society.
Walter Thiel,
Michael J. S. Dewar,
M. Dewar,
1977
.
Walter Thiel,
W. Thiel,
Jan Schöneboom,
2004
.
Walter Thiel,
S. R. Billeter,
Alexander J. Turner,
2000
.
Sergei N. Yurchenko,
Jonathan Tennyson,
Walter Thiel,
2013,
1302.1720.
Walter Thiel,
Michael Filatov,
W. Thiel,
1997
.
Walter Thiel,
Andrés M. Escorcia,
Markus Doerr,
2017
.
Walter Thiel,
Dirk Bakowies,
Achim Gelessus,
1992
.
Walter Thiel,
Serguei Patchkovskii,
1997
.
Walter Thiel,
Andreas Hirsch,
W. Thiel,
2003,
Chemphyschem : a European journal of chemical physics and physical chemistry.
Walter Thiel,
Wilfred F. van Gunsteren,
S. R. Billeter,
2001
.
Walter Thiel,
Serguei Patchkovskii,
Michael Bühl,
1997
.
Walter Thiel,
Stephan Thiel,
Wilfred F. van Gunsteren,
2008,
Physical chemistry chemical physics : PCCP.
Walter Thiel,
Wei-Hai Fang,
Ganglong Cui,
2017
.
Walter Thiel,
Hans Martin Senn,
H. Senn,
2007,
Current opinion in chemical biology.
Walter Thiel,
Thomas W. Keal,
W. Thiel,
2009
.
Walter Thiel,
Rong-Zhen Liao,
W. Thiel,
2012,
Journal of chemical theory and computation.
Walter Thiel,
Hans Bürger,
Jürgen Breidung,
1994
.
Walter Thiel,
Zhenggang Lan,
Eduardo Fabiano,
2009,
Chemphyschem : a European journal of chemical physics and physical chemistry.
Walter Thiel,
Alois Fürstner,
Cristina Nevado,
2007,
Chemistry.
Walter Thiel,
Serguei Patchkovskii,
S. Patchkovskii,
1996
.
Walter Thiel,
W. Thiel,
Wolfgang Weber,
2000
.
Paul von Ragué Schleyer,
Walter Thiel,
P. Schleyer,
2004,
Journal of the American Chemical Society.
Walter Thiel,
Bernd Engels,
Tanja Schirmeister,
2008,
The journal of physical chemistry. B.
Walter Thiel,
Zhenggang Lan,
Eduardo Fabiano,
2009,
The journal of physical chemistry. B.
Sason Shaik,
Walter Thiel,
Hajime Hirao,
2005,
Journal of the American Chemical Society.
Walter Thiel,
1997
.
Sason Shaik,
Walter Thiel,
Hai Lin,
2004,
Journal of the American Chemical Society.
Walter Thiel,
Michael Filatov,
W. Thiel,
2014,
The Journal of chemical physics.
Walter Thiel,
Iakov Polyak,
W. Thiel,
2013,
Physical chemistry chemical physics : PCCP.
Walter Thiel,
Miquel Moreno,
Ricard Gelabert,
2018,
Physical chemistry chemical physics : PCCP.
Yong Wang,
Sason Shaik,
Walter Thiel,
2010,
Chemical reviews.
Walter Thiel,
Michael J. S. Dewar,
M. Dewar,
1977
.
Walter Thiel,
Kerstin Möhle,
Hans-Jörg Hofmann,
2001
.
Walter Thiel,
Andrey Yachmenev,
Iakov Polyak,
2013,
The Journal of chemical physics.
Walter Thiel,
Johannes M. Dieterich,
Hans-Joachim Werner,
2010,
The Journal of chemical physics.
Walter Thiel,
Serguei Patchkovskii,
1999
.
Walter Thiel,
Thomas W. Keal,
Axel Koslowski,
2007
.
Walter Thiel,
W. Thiel,
Tobias Benighaus,
2008,
Journal of chemical theory and computation.
Sergei N. Yurchenko,
Jonathan Tennyson,
Walter Thiel,
2016,
1808.05431.
Walter Thiel,
Roberto Rinaldi,
Claudia Loerbroks,
2013,
Chemistry.
Toward accurate barriers for enzymatic reactions: QM/MM case study on p-hydroxybenzoate hydroxylase.
Walter Thiel,
Hans-Joachim Werner,
Ricardo A Mata,
2008,
The Journal of chemical physics.
Walter Thiel,
Manfred T. Reetz,
Karl-Erich Jaeger,
2003
.
Iris Antes,
Walter Thiel,
Wilfred F. van Gunsteren,
2002,
European Biophysics Journal.
Walter Thiel,
1998
.
Walter Thiel,
W. Thiel,
2005
.
Sason Shaik,
Walter Thiel,
Jingjing Zheng,
2006,
Journal of the American Chemical Society.
Walter Thiel,
W. Thiel,
Zhongfang Chen,
2003
.
Walter Thiel,
W. Thiel,
2014
.
Iris Antes,
Walter Thiel,
W. Thiel,
1999
.
Walter Thiel,
Michael J. S. Dewar,
M. Dewar,
1977
.
Walter Thiel,
Erix Wiliam Hernández-Rodríguez,
Ana Lilian Montero-Alejo,
2012,
The journal of physical chemistry. B.
Adrian J Mulholland,
Walter Thiel,
Frederick R Manby,
2006,
Angewandte Chemie.
Walter Thiel,
W. Thiel,
Walter Thiel,
1988
.
Walter Thiel,
Frank Schulz,
David Möller,
2017,
The journal of physical chemistry. B.
Walter Thiel,
Marko Schreiber,
W. Thiel,
2008,
The Journal of chemical physics.
Walter Thiel,
Jürgen Breidung,
W. Thiel,
2001
.
Wilfred F van Gunsteren,
Walter Thiel,
Stephan Thiel,
2007,
Journal of chemical theory and computation.
Frank Neese,
Walter Thiel,
F. Neese,
2005,
Journal of the American Chemical Society.
Walter Thiel,
W. Thiel,
Mario R Silva-Junior,
2010,
Journal of chemical theory and computation.
Iris Antes,
Walter Thiel,
W. Thiel,
1998
.
Walter Thiel,
Michael J. S. Dewar,
M. Dewar,
1977
.
Walter Thiel,
Andrew Komornicki,
Jürgen Breidung,
1988
.
Walter Thiel,
Eliot Boulanger,
2014,
Journal of chemical theory and computation.
Walter Thiel,
Volker Jonas,
W. Thiel,
1998
.
Gerrit Groenhof,
Walter Thiel,
Eduardo Fabiano,
2008
.
Walter Thiel,
Pavlo O. Dral,
Axel Koslowski,
2016,
Journal of chemical theory and computation.
Walter Thiel,
W. Thiel,
Bora Karasulu,
2015
.
Looking at self-consistent-charge density functional tight binding from a semiempirical perspective.
Walter Thiel,
Nikolaj Otte,
W. Thiel,
2007,
The journal of physical chemistry. A.
Walter Thiel,
Yiying Zheng,
Luping Liu,
2016,
Journal of the American Chemical Society.
Walter Thiel,
Michael Bühl,
Andreas Hirsch,
2001
.
Walter Thiel,
W. Thiel,
E. Boulanger,
2012,
Journal of chemical theory and computation.
Walter Thiel,
Paolo Costa,
P. Sokkar,
2016,
Nature Communications.
Walter Thiel,
Michael Bühl,
W. Thiel,
1995
.
Walter Thiel,
Zhenggang Lan,
Michael Filatov,
2011,
Journal of chemical theory and computation.
Walter Thiel,
Michael Bühl,
W. Thiel,
2002,
Chemistry.
Walter Thiel,
W. Thiel,
T. Tuttle,
2008,
Physical chemistry chemical physics : PCCP.
Walter Thiel,
W. Thiel,
Tobias Benighaus,
2009,
Journal of chemical theory and computation.
Walter Thiel,
W. Thiel,
A. Altun,
2005,
The journal of physical chemistry. B.
Walter Thiel,
Brent A. Gregersen,
Darrin M York,
2005,
The journal of physical chemistry. B.
Daniel Escudero,
Walter Thiel,
W. Thiel,
2014,
The Journal of chemical physics.
Walter Thiel,
Marko Schreiber,
Stephan P A Sauer,
2009,
Journal of chemical theory and computation.
Walter Thiel,
Sebastian Metz,
W. Thiel,
2009,
Journal of the American Chemical Society.
Walter Thiel,
W. Thiel,
E. Boulanger,
2017,
Journal of chemical theory and computation.
Walter Thiel,
Colin Thomson,
W. Thiel,
1988
.
Paul von Ragué Schleyer,
Walter Thiel,
Thomas Heine,
2004,
Chemistry.
Sason Shaik,
Walter Thiel,
Devesh Kumar,
2005,
Chemical reviews.
Walter Thiel,
Marko Schreiber,
Stephan P A Sauer,
2008,
The Journal of chemical physics.
Victor Guallar,
Sason Shaik,
Walter Thiel,
2006,
Journal of the American Chemical Society.
Klaus Schulten,
Thomas Frauenheim,
Walter Thiel,
2006,
Journal of the American Chemical Society.
Walter Thiel,
Mario Barbatti,
Pavlo O. Dral,
2018,
The journal of physical chemistry letters.
Sason Shaik,
Walter Thiel,
Devesh Kumar,
2005
.
Jonathan Tennyson,
Walter Thiel,
Andrey Yachmenev,
2015,
The Journal of chemical physics.
Walter Thiel,
Hans Martin Senn,
2009
.
Walter Thiel,
Christian Lennartz,
Frank Terstegen,
2002
.
Walter Thiel,
Andreas Vogel,
Karl-Erich Jaeger,
2007,
Chembiochem : a European journal of chemical biology.
Walter Thiel,
Paul Sherwood,
Johannes Kästner,
2009,
The journal of physical chemistry. A.
Walter Thiel,
W. Thiel,
S. Schröder,
1985
.
Walter Thiel,
Brent A. Gregersen,
Darrin M York,
2005,
The journal of physical chemistry. B.
Walter Thiel,
Serguei Patchkovskii,
S. Patchkovskii,
1997
.
Walter Thiel,
Dirk Bakowies,
W. Thiel,
1991
.
Walter Thiel,
Michael J. S. Dewar,
M. Dewar,
1975
.
Sason Shaik,
Walter Thiel,
Shimrit Cohen,
2005,
Journal of the American Chemical Society.
Walter Thiel,
Alexander A. Voityuk,
W. Thiel,
1992
.
Walter Thiel,
Alexander A. Voityuk,
W. Thiel,
1996
.
Walter Thiel,
Alexander A. Voityuk,
W. Thiel,
1992
.
Alexander D. MacKerell,
Bernard R Brooks,
Walter Thiel,
2018,
Molecules.
Walter Thiel,
Serguei Patchkovskii,
S. Patchkovskii,
1996
.
Walter Thiel,
W. Thiel,
A. Schweig,
1981
.
Walter Thiel,
Michael Bühl,
Dirk Bakowies,
1995
.
Walter Thiel,
Dirk Bakowies,
M. Kappes,
1992
.
Walter Thiel,
W. Thiel,
2014
.
Walter Thiel,
Axel Koslowski,
You Lu,
2016,
Journal of chemical theory and computation.
Walter Thiel,
1981
.
Frank Neese,
Walter Thiel,
Anakuthil Anoop,
2010,
Journal of Chemical Theory and Computation.
Walter Thiel,
W. Thiel,
Tiziana Z. Mordasini,
1998
.
Walter Thiel,
Hans Martin Senn,
Johannes Kästner,
2006,
Journal of chemical theory and computation.
Walter Thiel,
Volker Jonas,
W. Thiel,
1995
.
Walter Thiel,
Serguei Patchkovskii,
S. Patchkovskii,
1997
.
Walter Thiel,
W. Thiel,
2007
.
Walter Thiel,
Mario Barbatti,
M. Barbatti,
2015,
Chemphyschem : a European journal of chemical physics and physical chemistry.
Walter Thiel,
P. Sokkar,
W. Thiel,
2015,
Journal of chemical theory and computation.
Walter Thiel,
Zhenggang Lan,
Hans Lischka,
2012,
The Journal of chemical physics.
Walter Thiel,
Alexander A. Voityuk,
W. Thiel,
1994
.
Walter Thiel,
Manfred T Reetz,
Iakov Polyak,
2012,
Journal of the American Chemical Society.
Walter Thiel,
Bernd Engels,
Tanja Schirmeister,
2007,
ChemMedChem.
Enzymatic Hydroxylation in p-Hydroxybenzoate Hydroxylase: A Case Study for QM/MM Molecular Dynamics.
Walter Thiel,
Hans Martin Senn,
Stephan Thiel,
2005,
Journal of chemical theory and computation.