M. Strajbl

发表

Constraining the electron densities in DFT method as an effective way for ab initio studies of metal‐catalyzed reactions

A. Warshel, T. Wesołowski, G. Hong, 2000 .

Density Functional Calculations of the Pseudorotational Flexibility and Vibrational Spectra of Tetrahydrofuran, Ribose and Deoxyribose

J. Florián, M. Strajbl, V. Baumruk, 1997 .

Scaled Quantum Mechanical Force Fields and Vibrational Spectra of Nucleic Acid Constituents. 9. Tetrahydrofuran

J. Florián, M. Strajbl, and Vladimír Baumruk, 1998 .

How important are entropic contributions to enzyme catalysis?

A. Warshel, Y. Sham, M. Strajbl, 2000, Proceedings of the National Academy of Sciences of the United States of America.

Constraining the electron densities in DFT method as an effective way for ab initio studies of metal-catalyzed reactions

A. Warshel, T. Wesołowski, G. Hong, 2000, J. Comput. Chem..

Ab initio investigation of the molecular structure of methyl methoxymethyl phosphonate, a promising nuclease-resistant alternative of the phosphodiester linkage.

J. Florián, M. Strajbl, 1996, Journal of biomolecular structure & dynamics.

Remarkable rate enhancement of orotidine 5'-monophosphate decarboxylase is due to transition-state stabilization rather than to ground-state destabilization.

A. Warshel, J. Florián, M. Strajbl, 2000, Biochemistry.

Converting conformational changes to electrostatic energy in molecular motors: The energetics of ATP synthase

Arieh Warshel, Avital Shurki, Marek Strajbl, 2003, Proceedings of the National Academy of Sciences of the United States of America.

Conformational Flexibility of Phosphate, Phosphonate, and Phosphorothioate Methyl Esters in Aqueous Solution

A. Warshel, J. Florián, M. Strajbl, 1998 .

Electrostatic basis for bioenergetics.

A. Warshel, M. Strajbl, C. Schutz, 2004, Methods in enzymology.

Computational Design of Epitope-Specific Functional Antibodies.

Yanay Ofran, Guy Nimrod, Sharon Fischman, 2018, Cell reports.

Studies of proton translocations in biological systems: simulating proton transport in carbonic anhydrase by EVB-based models.

Arieh Warshel, Marek Strajbl, A. Warshel, 2004, Biophysical journal.

Density functional calculations of the pseudorotational flexibility of tetrahydrofuran

J. Florián, M. Strajbl, 1998 .

Apparent NAC effect in chorismate mutase reflects electrostatic transition state stabilization.

Arieh Warshel, Avital Shurki, Marek Strajbl, 2003, Journal of the American Chemical Society.

How much do enzymes really gain by restraining their reacting fragments?

A. Warshel, M. Strajbl, J. Villá, 2002, Journal of the American Chemical Society.

Accurate profiling of full-length Fv in highly homologous antibody libraries using UMI tagged short reads

Guy Nimrod, Y. Ofran, Dror Baran, 2023, Nucleic acids research.

Vibrational spectra and quantum mechanical force fields of modified oligonucleotide linkages: 1. methyl methoxymethanphosphonate

J. Florián, M. Strajbl, L. Bednárová, 1997 .

Calculations of Activation Entropies of Chemical Reactions in Solution

Arieh Warshel, Jordi Villà, Yuk Y. Sham, 2000 .

IR AND RAMAN SPECTRA, CONFORMATIONAL FLEXIBILITY, AND SCALED QUANTUM MECHANICAL FORCE FIELDS OF SODIUM DIMETHYL PHOSPHATE AND DIMETHYL PHOSPHATE ANION

Jan Florián, Vladimír Baumruk, J. Florián, 1996 .

G protein coupled receptors -in silico drug discovery and design.

H. Senderowitz, M. Strajbl, E. Ben-Zeev, 2010, Current topics in medicinal chemistry.

Ab Initio QM/MM Simulation with Proper Sampling: “First Principle” Calculations of the Free Energy of the Autodissociation of Water in Aqueous Solution

Arieh Warshel, A. Warshel, M. Strajbl, 2002 .

VB/MM protein landscapes: a study of the S(N)2 reaction in haloalkane dehalogenase.

M. Strajbl, T. Shnerb, Avital Sharir-Ivry, 2010, The journal of physical chemistry. B.

Circe Effect versus Enzyme Preorganization: What Can Be Learned from the Structure of the Most Proficient Enzyme?

A. Warshel, J. Florián, M. Strajbl, 2001, Chembiochem : a European journal of chemical biology.