trigram

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trigram frequency
as well as628
the presence of589
in order to563
structure of the414
one of the384
based on the377
of the protein345
the formation of336
the structure of317
the use of291
the development of290
due to the281
the number of274
in the presence268
the effect of262
can be used234
the role of233
the synthesis of217
a number of207
in this study197
of the peptide193
crystal structure of190
it has been188
analysis of the183
the active site176
a series of173
the mechanism of167
a variety of166
be used to164
to determine the159
to study the155
the design of155
in this work155
in addition to154
to investigate the152
the interaction of148
properties of the147
the case of147
involved in the146
part of the146
by means of143
a set of141
found to be137
show that the137
molecular dynamics simulations136
in the case136
the binding of133
in terms of131
the effects of130
that can be129
understanding of the128
was used to127
the study of127
of the most126
the crystal structure125
of the two124
of a protein124
the secondary structure124
well as the123
the aim of122
with respect to122
amino acid residues120
been shown to120
the analysis of120
shown to be120
to be a119
the identification of119
on the other118
in the present118
the amino acid118
a combination of116
the ability to116
have shown that115
changes in the114
role in the113
was found to112
has been shown111
the ability of111
the absence of111
structures of the110
is based on110
the importance of110
such as the110
as a result110
the surface of108
is one of108
the other hand107
there is a107
we found that106
structure of a105
of amino acids103
the results of103
related to the102
the influence of102
activity of the101
according to the101
the plasma membrane101
region of the100
the basis of100
of the human100
the treatment of99
used as a98
compared to the98
it is possible98
showed that the97
of the membrane97
the interaction between96
responsible for the96
the activity of96
to understand the96
an important role95
in which the95
based on a93
in the absence93
protein data bank92
the stability of92
the fact that90
some of the89
we show that89
results show that89
are able to88
important role in88
amino acid sequence88
were able to87
we have developed87
to that of87
nature of the87
formation of the87
the binding site87
shown that the86
on the surface86
role of the85
and in the85
were used to85
function of the85
the application of85
wide range of85
most of the85
a function of84
crystal structures of84
been used to84
suggest that the83
on the basis83
the present study82
large number of82
a wide range82
are involved in82
found that the81
the existence of80
the size of80
associated with the80
because of the80
stability of the80
depends on the79
the function of79
the structures of79
was carried out79
of the proteins79
formation of a79
of the binding79
be used for78
the regulation of78
the discovery of78
the structure and78
as a function77
residues in the77
in contrast to77
of the cell77
effect of the77
of this study77
was supported by77
of amino acid76
for the development76
were found to75
this work was75
of the structure75
structure and function74
to identify the73
will be discussed73
found in the73
have been used73
that of the73
will be presented73
of the rna72
of the n72
in the protein72
in the same72
phase peptide synthesis72
the free energy72
of the enzyme72
results suggest that71
in complex with71
is possible to71
are known to71
the conformation of70
used for the70
known to be70
aim of this70
in vitro and69
and in vivo69
in response to69
present in the69
the end of68
atomic force microscopy68
of the c68
depending on the68
study of the68
the rate of68
of the target67
we present a67
the nature of67
information on the67
a large number67
the range of67
binding to the67
the production of66
a range of66
is able to66
model of the66
be involved in66
revealed that the66
the process of66
rna secondary structures66
was shown to66
has been used65
the prediction of65
and can be65
to be the65
size of the65
in the pdb65
each of the65
insight into the64
characterization of the64
the dynamics of64
of the peptides64
which can be64
derived from the63
conformation of the63
surface of the63
binding of the63
due to its63
the accuracy of63
interaction with the63
the determination of63
interactions between the63
interaction of the63
for the treatment62
at the n62
the sequence of62
to evaluate the62
here we present62
is known to61
nuclear magnetic resonance61
mechanism of action61
is involved in61
information about the61
of the complex61
is used to61
as a model60
effect on the60
secondary structure of60
have been developed60
the kinetics of60
the target protein60
in combination with60
the level of60
we report the60
determination of the60
the majority of59
structural and functional59
has also been59
for the design59
at the c59
be used as59
similar to that59
of the same58
the lack of58
the properties of58
presence of a58
of the ligand58
to interact with58
key role in58
which is a58
a result of58
of the three58
of the amino58
of these peptides58
of the compounds58
there is no57
the amount of57
to predict the57
we have used57
used in the57
of the sars57
state of the57
of the virus57
to improve the57
mechanism of the57
proteins in the57
the distribution of57
d structure of56
we investigated the56
has not been56
a role in56
the cell membrane56
work was supported56
the detection of56
end of the56
length of the56
between the two56
and it is56
features of the56
can also be56
it was shown56
is required for56
of the viral55
biological activity of55
the protein data55
change in the55
presence of the55
due to their55
vitro and in55
of a new55
intrinsically disordered proteins55
in the cell55
we were able55
severe acute respiratory55
acute respiratory syndrome55
a key role55
in living cells55
the lipid bilayer54
seems to be54
leading to the54
the present work54
increase in the54
amino acid sequences54
this study we54
consistent with the54
is an important54
we have shown54
results indicate that54
members of the54
shown in fig54
it can be54
it was found54
insights into the53
rna secondary structure53
was used as52
is shown in52
study was to52
were carried out52
to elucidate the52
this study was52
to form a52
it is a51
member of the51
amino acids and51
indicate that the51
corresponding to the51
we have also51
close to the51
have also been51
for the synthesis51
of a novel51
of a single50
in the development50
of action of50
active site of50
all of the50
this work we50
play an important50
protein structure prediction50
in the membrane50
interaction between the50
and characterization of50
the quality of50
observed in the50
a database of50
solid phase peptide50
the degree of50
the length of50
and function of50
the combination of49
domain of the49
our understanding of49
appears to be49
is essential for49
shows that the49
to the formation49
at the same49
transmission electron microscopy49
that have been49
site of the49
suggests that the49
the possibility of49
the most common49
is due to49
and dynamics of49
van der waals49
some of these48
at the end48
the activation of48
the introduction of48
is responsible for48
have not been48
for the first48
was found that48
to analyze the48
use of the48
is associated with47
we present the47
the side chain47
led to the47
the preparation of47
respect to the47
has been developed47
the first time47
that there is47
of membrane proteins47
on the structure47
sequence of the47
we studied the47
a and b47
be used in46
in the first46
dynamics of the46
supported by the46
the fi rst46
used to determine46
located in the46
the characterization of46
of protein structure46
were shown to46
in the literature46
amino acids in46
to be involved45
the most important45
their ability to45
it is not45
in this context45
is crucial for45
results of the45
structure and dynamics45
we have studied45
addition to the45
in the range45
of the native45
are shown in45
have been identified45
differences in the45
in the brain45
knowledge of the45
the expression of45
regions of the45
free energy of45
of the interaction45
we showed that45
comparison of the45
dynamic light scattering44
structures in the44
formed by the44
studies of the44
determined by the44
the interaction with44
of these proteins44
characterized by a44
many of the44
as compared to44
to the protein44
isothermal titration calorimetry44
allowed us to44
development of a44
focused on the43
to explore the43
in this case43
interact with the43
we have investigated43
the concentration of43
need to be43
structural basis for43
contribute to the43
are used to43
amino acid composition43
the relationship between43
the wild type43
a total of42
which is the42
and molecular dynamics42
in recent years42
been shown that42
has been proposed42
of the sequence42
was shown that42
appear to be42
of protein structures42
of the dna42
a family of42
we have found42
of this work42
the context of42
the biological activity42
have been found42
of proteins and42
department of chemistry42
scanning electron microscopy41
fluorescence correlation spectroscopy41
than that of41
the growth of41
by using the41
in the regulation41
dependent on the41
leads to the41
is that the41
academy of sciences41
in the sequence41
were synthesized by41
to assess the41
applied to the41
is a key41
of the molecule41
used to study41
central nervous system41
together with the41
the search for41
of rna secondary41
peptides and proteins41
different types of41
followed by a41
basis of the40
in agreement with40
the course of40
of a large40
our results show40
we developed a40
belongs to the40
it is also40
demonstrated that the40
the inhibition of40
a member of40
to the membrane40
have been studied40
position of the40
suggested that the40
studies on the40
important for the40
resulted in the40
the generation of40
is important to39
is composed of39
in the formation39
interactions with the39
the incorporation of39
of secondary structure39
here we report39
in the structure39
are characterized by39
the action of39
well as in39
compared with the39
to obtain the39
synthesis of the39
for the study39
leads to a39
depend on the39
attached to the39
to characterize the39
shown in figure39
could be used39
binding site of39
secondary structure prediction38
basis for the38
it is important38
the protein is38
the interactions between38
similar to the38
prediction of protein38
regulation of the38
plays an important38
the cell surface38
surface plasmon resonance38
the set of38
component of the38
the structural and38
in comparison with38
for drug discovery38
of the a38
the purpose of38
peptides derived from38
better understanding of38
in the binding38
the same time38
of intrinsic disorder38
in aqueous solution38
of which are38
the mechanisms of38
this is the38
obtained from the38
in the past38
bound to the38
of the molecular38
side of the38
the synthesis and38
a model of38
be able to38
have been shown37
development of new37
new class of37
the d structure37
be considered as37
these results suggest37
is the most37
the protein structure37
of the reaction37
are based on37
an example of37
in the field37
secondary and tertiary37
referred to as37
in case of37
and that the37
is characterized by37
of the lipid37
in this way37
by using a37
the position of37
is believed to37
also known as37
likely to be37
effects of the37
the assembly of36
acts as a36
out of the36
secondary structure elements36
in presence of36
has been suggested36
human immunodeficiency virus36
a protein structure36
orientation of the36
with the same36
in the following36
of proteins in36
increase of the36
the impact of36
method for the36
agreement with the36
in the context36
the order of36
we have been36
of the s36
to be used36
caused by the36
investigation of the36
results showed that36
suggesting that the36
the basis for36
this type of36
the investigation of35
influence of the35
inhibitors of the35
inhibition of the35
of the active35
based on these35
we used the35
the field of35
model for the35
can be found35
the changes in35
we find that35
and of the35
the results obtained35
belonging to the35
the amino acids35
have to be35
of a peptide35
and for the35
based drug design35
resulted in a35
by the presence35
the binding pocket35
be applied to35
synthesis of a35
of all the35
that it is35
molecular mechanism of35
ability of the35
of the receptor35
of this protein35
of the model35
as shown in35
two types of35
of the main35
residues of the35
a powerful tool35
step in the34
required for the34
have developed a34
this work is34
structure in the34
serve as a34
results in a34
the understanding of34
has to be34
accuracy of the34
can be obtained34
to each other34
is important for34
based on their34
to bind to34
the molecular level34
contrast to the34
of the different34
in the central34
on the cell34
of the first34
allows us to34
of antimicrobial peptides34
vp vp vp34
the release of34
of the resulting34
have been reported34
to be more34
have been proposed34
for this purpose33
are responsible for33
the addition of33
was applied to33
the evolution of33
de novo design33
organization of the33
be related to33
in silico pharmacology33
the results show33
in drug discovery33
was used for33
we have recently33
to obtain a33
can be applied33
there is an33
has been studied33
the eudoc program33
dynamics simulations of33
is consistent with33
the interactions of33
to play a33
the side chains33
been found to33
and in vitro33
in the last33
the first step33
resonance energy transfer33
at least one33
of the secondary33
proteins involved in33
considered to be33
of the sample33
of the major33
to develop a33
in the n33
terminal domain of33
the potential of33
protein structure and32
mode of action32
with the aim32
thought to be32
point of view32
is a powerful32
the central nervous32
intrinsic disorder in32
the host cell32
the complexity of32
structural analysis of32
one or more32
structures can be32
to increase the32
at least two32
of the molecules32
in the future32
used to identify32
a model system32
dependence of the32
the location of32
components of the32
of protein folding32
the human genome32
be responsible for32
in a single32
for the binding31
proteins can be31
dependent rna polymerase31
bind to the31
was studied by31
an increase in31
the in vitro31
solid phase synthesis31
conformational changes in31
to the presence31
data suggest that31
in vivo and31
assembly of the31
was able to31
reduction of the31
rational design of31
evaluation of the31
to inhibit the31
a class of31
are associated with31
form of the31
its interaction with31
in some cases31
as a consequence31
designed and synthesized31
on the protein31
because of their31
the construction of30
of the structures30
and on the30
have investigated the30
the tertiary structure30
em structure of30
in the peptide30
consists of a30
methods have been30
to have a30
parts of the30
the crystal structures30
interactions in the30
of the four30
of secondary structures30
is the first30
we propose that30
has been determined30
in a protein30
in the crystal30
a group of30
at the molecular30
secondary structure and30
details of the30
importance of the30
could not be30
the molecular mechanism30
to the cell30
be important for30
distribution of the30
of these two30
so that the30
the resolution of30
carried out using30
the type of30
molecules in the30
we will present30
wide variety of30
the significance of30
which has been30
of the catalytic30
is used for30
is related to30
structural characterization of30
the behavior of30
the binding affinity30
may lead to29
for the detection29
it is well29
is known that29
we used a29
activation of the29
in escherichia coli29
is a very29
the performance of29
energy of the29
prediction of the29
at room temperature29
the concept of29
structure determination of29
based virtual screening29
the molecular mechanisms29
were used as29
has been found29
when compared to29
in the early29
the folding of29
seem to be29
the occurrence of29
starting from the29
as in the29
results in the29
a secondary structure29
of the system29
it is known29
identification of a29
by nmr spectroscopy29
can be easily29
diseases such as29
of the surface29
believed to be29
that there are29
we have synthesized29
in the c29
can be considered29
of the full29
and the other29
a crucial role29
because of its29
use of a29
have found that29
changes of the29
conformational changes of29
carried out by29
taken into account29
of these structures29
shape of the28
isolated from the28
lead to the28
the rest of28
values of the28
has been reported28
be due to28
core of the28
in most cases28
we have designed28
of the new28
its ability to28
molecular dynamics simulation28
effects on the28
is necessary to28
in the second28
act as a28
indicated that the28
dimensional structure of28
the peptides were28
the loss of28
are important for28
to measure the28
the goal of28
the control of28
in the human28
with a high28
that could be28
in a variety28
in the treatment28
linked to the28
a change in28
of these compounds28
this is a28
to examine the28
the evaluation of28
we have previously28
serves as a28
has recently been28
dimensional structures of28
similar to those28
structure and the28
in the active28
we propose a28
proven to be28
reactive oxygen species28
is likely to28
of structural biology28
proved to be28
crucial for the28
difference between the28
amino acid residue27
the affinity of27
a part of27
peptides were synthesized27
play a role27
in this paper27
needs to be27
light on the27
with high affinity27
is present in27
the form of27
mechanical properties of27
that they are27
identifi cation of27
view of the27
to the active27
design of new27
been applied to27
binds to the27
identification of the27
of a small27
expected to be27
is mediated by27
in the s27
a mixture of27
to better understand27
located at the27
force field for27
correlation between the27
leading to a27
for the discovery27
is thought to27
to the same27
data on the27
of the crystal27
we describe the27
to calculate the27
data show that27
composition of the27
studies showed that27
considered as a27
of the p27
a highly conserved27
was determined by27
native chemical ligation27
recent advances in27
a wide variety27
and biological activity27
along with the27
and the c27
activity in the27
this study is27
mediated by the27
plays a key27
it should be27
may be a27
may not be27
some of them26
of the entire26
the details of26
there are several26
to those of26
were subjected to26
more than one26
high affi nity26
studies have shown26
be found in26
have been described26
side chains of26
is capable of26
were used for26
of the conformational26
cleavage of the26
order to obtain26
deposited in the26
case of the26
sequence and structure26
powerful tool for26
the efficiency of26
affected by the26
relies on the26
allow us to26
institute of technology26
terminus of the26
essential for the26
been implicated in26
crucial role in26
department of physics26
to reduce the26
that may be26
access to the26
is supported by26
were synthesized and26
a comparison of26
been suggested that26
induced by the26
of such a26
of the second26
relative to the26
the specificity of26
which have been26
confocal laser scanning26
to the n26
characterization of a26
to test the26
and development of26
a method for26
the availability of26
that has been26
this approach is26
a better understanding26
a model for26
used to predict26
the orientation of26
belong to the26
of small molecules26
based on this26
a new method26
in the design26
were prepared by26
virtual screening of26
proteins and their26
has been recently26
with and without26
a new class25
the protein surface25
of proteins with25
a library of25
side chain of25
rest of the25
attributed to the25
as an example25
a basis for25
these peptides are25
we believe that25
of more than25
amino acids were25
characterized by the25
are found in25
scanning electron microscope25
and tertiary structure25
change of the25
are the most25
properties of a25
the results are25
our results suggest25
is essential to25
binding sites in25
to understand how25
amino acids are25
were characterized by25
into account the25
interacts with the25
of the drug25
and structure of25
size exclusion chromatography25
in the two25
quality of the25
well as to25
the organization of25
to the structure25
consists of two25
protein in the25
due to a25
by solid phase25
we demonstrate that25
correlated with the25
molecular basis of25
been developed for25
the result of25
of peptides and25
have been investigated25
that are not24
and has been24
background and aims24
is a major24
are used in24
indicating that the24
we investigate the24
is determined by24
the compounds were24
in the plasma24
we conclude that24
structural properties of24
of the host24
of the folding24
majority of the24
indicates that the24
part of a24
of base pairs24
we suggest that24
of the structural24
order to study24
a major role24
the polypeptide chain24
the university of24
tool for the24
the difference in24
the protein and24
we report on24
in the identification24
evolution of the24
low molecular weight24
and nucleic acids24
and to the24
the viral rna24
limited number of24
structures have been24
be useful for24
only a few24
the most potent24
to monitor the24
carried out in24
been found in24
processes such as24
differential scanning calorimetry24
structure of human24
the molecular basis24
aim is to24
using a combination24
is dependent on24
in relation to24
amino acid side24
this suggests that24
to create a24
in our laboratory24
that do not24
work was to24
be associated with24
is formed by24
small angle x24
institute of biophysics24
the possibility to24
by molecular dynamics24
those of the24
the local structures24
focus on the24
is known about24
on the membrane24
they can be24
interacting with the24
orders of magnitude24
starting point for24
taking into account24
of rna structure24
differences between the24
to explain the24
the aggregation of24
it is the24
protein can be24
of a given24
proteins and peptides24
for the prediction24
to form the24
used as the24
in other words24
the target sequence24
in spite of24
in the cytoplasm23
we report a23
the center of23
is the main23
order to understand23
of amyloid fibrils23
may be used23
affinity of the23
to control the23
the experimental data23
were obtained from23
advantage of the23
it possible to23
states of the23
of local structures23
we demonstrated that23
evidence that the23
simulations of the23
and analysis of23
also in the23
high degree of23
in comparison to23
across the membrane23
sites of the23
of glutamic acid23
the most promising23
for the preparation23
concentration of the23
by circular dichroism23
the in vivo23
the pathogenesis of23
the increase of23
on the use23
both in the23
it may be23
the help of23
of the backbone23
added to the23
cell penetrating peptides23
it is necessary23
structural features of23
upon binding to23
carried out on23
resulting in the23
molecular mechanisms of23
the design and23
were tested for23
a consequence of23
of protein function23
flexibility of the23
been used for23
on the interaction23
has been demonstrated23
ray crystallography and23
in many cases23
that the protein23
amino acids with23
of the free23
of the hiv23
the calculation of23
the hypothesis that23
for the identification23
of the complexes23
in the process23
the contribution of23
the peptide backbone23
secondary structure is23
conformational analysis of23
to the development23
glutamic acid residues23
the problem of23
complex with the23
to describe the23
proteins of the23
the mode of23
we aim to22
in the number22
that the structure22
a hydrogen bond22
the selection of22
of this enzyme22
corresponds to the22
mutations in the22
antimicrobial activity against22
d structures of22
example of a22
and stability of22
such as a22
work is to22
a decrease in22
the extent of22
liu et al22
conformations of the22
the reaction of22
been identified in22
is a potent22
the association of22
by mass spectrometry22
peptides have been22
is represented by22
structure of an22
approaches have been22
has led to22
interactions of the22
which may be22
is well known22
to find the22
study is to22
removal of the22
to show that22
each of these22
of the electron22
more stable than22
of the residues22
existence of a22
known as the22
the distance between22
the increase in22
unnatural amino acids22
amino acids that22
associated with a22
complexity of the22
of the present22
of the protease22
under physiological conditions22
is achieved by22
action of the22
distance between the22
are essential for22
in conjunction with22
the shape of22
on the molecular22
of the d22
resulting from the22
description of the22
to determine whether22
in the rat22
to provide a22
of the natural22
but it is22
plasma membrane of22
rdrp suppl table22
of hydrogen bonds22
is not a22
web server for22
geometry of the22
structural basis of22
atoms of the22
on the structural22
to be an22
has been observed22
of a series22
and the structure22
is similar to22
is possible that22
of this approach22
modification of the22
two of the22
portion of the22
of the substrate22
from the protein22
small number of22
well as their22
were determined by22
hepatitis c virus22
to estimate the22
half of the22
affinity for the22
solution structure of22
application of the22
is still a22
were obtained by22
of the other22
order to investigate22
respiratory syndrome coronavirus22
was to investigate22
it does not22
has shown that22
characteristics of the21
the conformational changes21
the focus of21
led to a21
an understanding of21
is in the21
lead to a21
multiple sequence alignment21
a way that21
of both the21
tested for their21
in the other21
the extracellular matrix21
difference in the21
provided by the21
can be observed21
of the non21
model based on21
nucleotides in the21
demonstrate that the21
was observed in21
acid residues in21
in the form21
the secondary structures21
we use the21
this class of21
the binding sites21
has been identified21
university of california21
results from the21
with the protein21
mechanisms of action21
are likely to21
been widely used21
a method to21
broad range of21
of the genome21
interest in the21
resolution of the21
seen in the21
of the b21
the potential to21
roles in the21
with that of21
an in vitro21
profile of the21
to be highly21
the core of21
by interacting with21
can be seen21
terminal part of21
little is known21
the measurement of21
inhibitor of the21
the correlation between21
potent and selective21
have been characterized21
proteins have been21
development of the21
to the peptide21
is expected to21
science and technology21
order to determine21
to generate a21
can serve as21
the geometry of21
able to bind21
prediction of rna21
peptides and their21
calculation of the21
decrease of the21
have studied the21
of the plasma21
structure has been21
to detect the21
to the surface21
and amino acid21
aim of the21
site in the21
structures of proteins21
during the last21
of the compound21
to be important21
the conversion of21
of the known20
physical properties of20
fact that the20
is regulated by20
dynamics of a20
of the corresponding20
parallel to the20
of molecular dynamics20
in the study20
good agreement with20
a protein is20
in a wide20
of the primary20
that the n20
laser scanning microscopy20
with the help20
one of these20
for understanding the20
to the high20
developed for the20
can then be20
the peptide sequence20
structural studies of20
results demonstrate that20
binding affinity of20
of the polypeptide20
the similarity of20
observed for the20
to compare the20
proteins such as20
were used in20
is a member20
as a new20
the frequency of20
as determined by20
department of biophysics20
are related to20
is difficult to20
design and synthesis20
a novel approach20
used as an20
as a template20
we focus on20
plays a role20
are expected to20
with each other20
an ensemble of20
nmr studies of20
location of the20
limited by the20
for binding to20
the value of20
of the individual20
was obtained by20
in the course20
in both the20
the catalytic domain20
could be a20
a resolution of20
of intrinsically disordered20
have been synthesized20
we observed that20
the observation that20
behavior of the20
the most active20
have been determined20
an attempt to20
of the nucleocapsid20
resulting in a20
of water molecules20
kinetics of the20
been studied by20
graduate school of20
parameters of the20
the method is20
binding of a20
were performed in20
secondary structure in20
over the past20
of the t20
been developed to20
binding free energy20
for the formation20
of the g20
to optimize the20
cells of the20
in the search20
in vivo studies20
it will be20
of at least20
relationship between the20
studies have been20
the native state20
this process is20
of crystal packing20
we will show20
for in vivo20
cells in the20
and synthesis of20
with the membrane20
phase synthesis of20
we analyzed the20
a high degree20
the modulation of20
can be achieved20
approach for the20
followed by the20
the creation of20
approach to the20
of the whole20
a critical role19
in the model19
of negatively charged19
and molecular modeling19
the change in19
presence of an19
also be used19
of the functional19
to act as19
secondary structures of19
suitable for the19
on the contrary19
of a number19
it was also19
of the data19
we report here19
base pair similarity19
as a potential19
coordinates of the19
many of these19
it was suggested19
incorporated into the19
drug discovery process19
infl uence of19
techniques such as19
for each of19
and found that19
a target for19
green fluorescent protein19
be explained by19
of our study19
analysis of a19
a starting point19
methods such as19
is a well19
purpose of this19
in the lipid19
we focused on19
binding mode of19
influence on the19
the reduction of19
to probe the19
critical role in19
potential of the19
tertiary structure of19
included in the19
in the nucleus19
the viral genome19
the need for19
as part of19
the electron density19
proteins and nucleic19
linked to a19
it is shown19
on the sequence19
all of these19
in the vicinity19
a subset of19
the primary structure19
due to an19
to reveal the19
binding site for19
is a highly19
the sequence and19
the native structure19
in mammalian cells19
residues involved in19
of a few19
the morphology of19
the binding mode19
for virtual screening19
secondary structures are19
identified in the19
can lead to19
assumed to be19
acid sequence of19
of gene expression19
in a large19
of the wild19
in our study19
is an essential19
be divided into19
sensitive to the19
design of a19
of biologically active19
binding sites of19
positions of the19
of the local19
the differences in19
defined by the19
any of the19
are present in19
affi nity for19
for drug design19
as it is19
in the viral19
gives rise to19
of in silico19
goal is to19
can be determined19
composed of a19
of the selected19
cancer cell lines19
the origin of19
major role in19
proteins that are19
have been made19
a new approach19
in which a19
an effort to19
morphology of the19
for a given19
linear and cyclic19
and the binding19
give rise to19
we examined the19
in an effort19
of the original19
observed that the19
design of novel19
glutamic acid is19
position in the19
secondary structures with19
density of the19
analysis revealed that19
the dependence of19
been proposed to19
have demonstrated that19
binding site on18
formation of an18
and with the18
a small number18
here we show18
were identified by18
been carried out18
of them are18
correspond to the18
by the formation18
the vicinity of18
of the interactions18
there are many18
novo design of18
of an rna18
of science and18
is a promising18
the toxicity of18
in a way18
terminal region of18
zhang et al18
the outer membrane18
to be considered18
there are two18
binding domain of18
at the level18
in the interaction18
these proteins are18
binding properties of18
development of novel18
that the binding18
we are interested18
and there is18
has been widely18
we present an18
was monitored by18
do not have18
homology model of18
the main chain18
the major groove18
can be divided18
protein secondary structure18
can only be18
protein from the18
of the helix18
the inclusion of18
the results showed18
analysis of protein18
on a single18
structures and functions18
present work we18
has been described18
in live cells18
here we describe18
the involvement of18
properties of these18
a crystal structure18
protein of the18
a pair of18
of the transition18
efficiency of the18
only in the18
essential role in18
comparison with the18
divided into two18
at the single18
for the investigation18
of escherichia coli18
combined with the18
of the cells18
the past years18
protein and the18
were calculated using18
structures and the18
that the peptide18
for use in18
be the most18
sequences of the18
at least in18
with the use18
the elucidation of18
by a single18
was studied in18
in silico screening18
mechanism by which18
of some of18
will be used18
for all the18
picture of the18
example of the18
in the low18
the membrane and18
to the synthesis18
the values of18
of the large18
the fraction of18
stabilization of the18
the minor groove18
discovery of new18
an increase of18
the flexibility of18
there has been18
biologically active peptides18
are required to18
was performed in18
one of them18
in regulation of18
for protein structure18
which in turn18
for the interaction18
we demonstrate the18
release of the18
of living cells18
protein intrinsic disorder18
as one of18
to the target18
was investigated by18
the template structure18
with a single18
s and s18
in view of18
unfolding of the18
functions of the18
binding site in18
results indicated that18
is widely used18
for treatment of18
the sum of18
to overcome this18
from the n18
fraction of the18
in silico methods18
of binding sites18
the appearance of18
p x r17
with the active17
the variation of17
combination of the17
increasing number of17
in both cases17
experiments showed that17
is caused by17
by a combination17
the types of17
are consistent with17
has been applied17
groups of the17
share a common17
high levels of17
conclude that the17
of the in17
the virtual screening17
the sars coronavirus17
ability to form17
of the cellular17
cd and nmr17
at physiological ph17
binding sites for17
the protein in17
of the bacterial17
the training set17
methods for the17
that the presence17
the interplay between17
modulation of the17
was found in17
there was a17
an amino acid17
of this peptide17
on the analysis17
can be a17
were found in17
seq x and17
analysis showed that17
determined by nmr17
for the analysis17
the asymmetric unit17
motion of the17
the full length17
the last years17
work we have17
islet amyloid polypeptide17
acids in the17
by measuring the17
important roles in17
antimicrobial activity of17
for their ability17
was performed by17
developed a novel17
the development and17
the peptide was17
the membrane surface17
terms of the17
play a key17
been associated with17
degrees of freedom17
the accumulation of17
is necessary for17
target for the17
these results indicate17
is a protein17
of a ligand17
the monte carlo17
the method of17
away from the17
the region of17
a glutamic acid17
and the number17
the recognition of17
determined by x17
is followed by17
able to interact17
ranging from to17
and secondary structure17
results on the17
an essential role17
a single protein17
modeling of the17
using nmr spectroscopy17
of drug discovery17
our results indicate17
is part of17
expressed in the17
new insights into17
studies revealed that17
the coupling of17
in the outer17
sequences in the17
known that the17
not yet been17
the template and17
of the biological17
protein folding and17
the functions of17
the protein to17
to our knowledge17
produced by the17
molecules have been17
a lot of17
have the ability17
of rna molecules17
of the mechanism17
also been used17
can be done17
are difficult to17
rna structure prediction17
we designed a17
results of this17
residues at the17
aim was to17
is used as17
peptides can be17
in the current17
the most stable17
in cancer cells17
studies were performed17
binding to a17
integral membrane proteins17
the advantage of17
we are currently17
amino group of17
of the disulfide17
models of the17
number of protein17
in real time17
well as a17
modifi cation of17
of the actin17
circular dichroism and17
is critical for17
the usefulness of17
a study of17
each amino acid17
of the virion17
the site of17
that the two17
there have been17
we are able17
d structural data16
was based on16
to mimic the16
a lipid bilayer16
of the total16
are interested in16
this indicates that16
with those of16
the last decade16
expression of the16
is the major16
a very high16
structural changes in16
to the fact16
because they are16
and mechanism of16
domain and the16
in the hydrophobic16
that the number16
to establish the16
comparable to that16
in determining the16
to address the16
fold into a16
allows for the16
carried out to16
the intrinsically disordered16
of the pore16
are considered to16
electrostatic interactions between16
kagome lattice structure16
as a basis16
and the corresponding16
in the synthesis16
tools for the16
in the complex16
regions in the16
and compared with16
described in the16
elements in the16
have been widely16
order to identify16
sensitivity and selectivity16
can be studied16
independent of the16
to the binding16
of the process16
of sequences and16
of nucleic acid16
xu et ai16
structure can be16
the replacement of16
enabled us to16
with the binding16
was confirmed by16
in such a16
study on the16
and it was16
and as a16
potent inhibitors of16
on solid support16
approach based on16
active site and16
broad spectrum of16
the selected compounds16
a homology model16
in the secondary16
well known that16
high affinity for16
of the central16
expressed in e16
that the interaction16
the innate immune16
has emerged as16
of these molecules16
was achieved by16
the structural basis16
a protein with16
local structures and16
the decrease of16
may contribute to16
as an alternative16
study of a16
in protein structures16
formation of amyloid16
we have applied16
a neural network16
the structural features16
the knowledge of16
the proteins were16
binding site is16
are considered as16
are crucial for16
when compared with16
the scope of16
have been performed16
goal of this16
for this reason16
we have demonstrated16
of the sequences16
to be responsible16
of a particular16
should be noted16
the sequences of16
taking advantage of16
it is believed16
chemical properties of16
arrangement of the16
of the high16
virtual screening for16
to changes in16
peptide derived from16
an analysis of16
is found in16
because it is16
in the template16
peptides corresponding to16
emerged as a16
our aim is16
were performed using16
in an attempt16
on the nature16
contributes to the16
the difference between16
the content of16
contribution of the16
p and p16
in all cases16
play a crucial16
red blood cells16
of the channel16
involved in a16
a single molecule16
be noted that16
the protein chain16
implicated in the16
in the database16
a role for16
vivo and in16
an in silico16
may be the16
structure of this16
the catalytic site16
experimental and computational16
from the literature16
in water and16
the actin cytoskeleton16
structures of rna16
using circular dichroism16
the most abundant16
to be very16
as a novel16
order to find16
of the chemical16
of the e16
we study the16
of a structure16
could also be16
molecular mass of16
of proteins that16
discovery of novel16
we carried out16
of ion channels16
in the middle16
the thermal stability16
the peptide chain16
found in a16
activity of a16
of the h16
were studied by16
the binding to16
domains of the16
aim of our16
we have performed16
very similar to16
report on the16
of in vitro16
of the energy16
to the identification16
the integration of16
the behaviour of16
cell adhesion and16
a small molecule16
comparative analysis of16
in this region16
the delivery of16
selection of the16
can be explained16
affi nity and16
for the production16
aspects of the16
was suggested that16
the in silico16
been able to16
content of the16
explained by the16
logarithm of the16
at the cell16
extension of the16
for the determination16
it is likely16
are among the16
in a number16
ray crystal structure16
the results indicate16
before and after16
to confirm the16
we determined the16
t h e16
which could be16
is limited by16
it is still16
proportional to the16
number of different16
a list of16
comparative protein structure16
widely used for16
group of the16
alignment of the16
means of the16
recognition of the16
the transition state16
to define the15
a molecular level15
structure with a15
single molecule fluorescence15
of idps idprs15
have the same15
note that the15
the specifi c15
were investigated by15
understand the role15
among the most15
vast majority of15
the rational design15
specificity of the15
to the c15
report the synthesis15
of the coronavirus15
in this field15
of the presence15
have recently been15
application of this15
molecular biology and15
and a c15
important in the15
nmr structure of15
the solid phase15
of dna and15
the middle of15
of the current15
the vast majority15
contribution to the15
the venom of15
is stabilized by15
method was used15
by increasing the15
is an attractive15
the hydrophobic core15
tertiary structures of15
showing that the15
may be of15
order to improve15
or in the15
especially in the15
number of structures15
most of them15
of the fluorescence15
we decided to15
this protein is15
acid side chains15
is considered to15
high level of15
context of the15
inhibitory activity of15
the response of15
has been performed15
potent inhibitor of15
not only for15
as they are15
the composition of15
shed light on15
forms of the15
is to develop15
of the carbohydrate15
protein structure modeling15
monte carlo simulation15
of the chromophore15
our aim was15
a broad range15
they do not15
suggested to be15
nmr spectroscopy and15
early stages of15
used to assess15
and tertiary structures15
are located in15
of a human15
evidence suggests that15
the de novo15
impact on the15
is close to15
the electron beam15
absence of the15
new method for15
there are no15
study the effect15
a tree decomposition15
protein fold recognition15
of the trna15
physicochemical properties of15
the proteins in15
of ordered proteins15
of the self15
conformation of a15
structures that are15
the base of15
shown in table15
disruption of the15
the comparison of15
supported by a15
root mean square15
with the experimental15
widely used in15
discussed in the15
developed a new15
is the only15
to form an15
influence of crystal15
of great interest15
is very important15
that in the15
a serine protease15
is shown that15
at atomic resolution15
conformational preferences of15
analyses of the15
of molecular biology15
able to inhibit15
the fi nal15
the severe acute15
power of the15
docking and scoring15
applications of the15
an antimicrobial peptide15
molecule in the15
this method is15
c and c15
level of the15
an alternative to15
the antimicrobial activity15
amber force field15
molecular dynamics and15
chains of the15
the drug discovery15
able to detect15
be attributed to15
a tool for15
to design a15
known to bind15
of the best15
using molecular dynamics15
the y e15
protein of interest15
necessary for the15
in our previous15
taken from the15
to the native15
a long time15
of the results15
to generate the15
from the venom15
investigate the effect15
to form amyloid15
to the structural15
listed in table15
structures based on15
showed that a15
of the basic15
our data suggest15
in the final15
time of the15
charge of the15
is compatible with15
in solution and15
for design of15
the presence and15
are needed to15
residues that are15
detected in the15
the folding process15
regulated by the15
giant unilamellar vesicles15
then used to15
to distinguish between15
the partition coefficient15
result of the15
critical for the15
representation of the15
of the guest15
which leads to15
the stabilization of15
the intensity of15
evidence for a15
of which is15
one of its15
protein interactions and15
with the highest15
we designed and15
volume of the15
occur in the15
to atomic resolution15
temperature dependence of15
to a protein15
from the same15
in our work15
the family of15
functional properties of15
higher than the15
of these methods15
the negatively charged15
of the ribosome15
has been solved15
the maintenance of15
and mass spectrometry15
to search for15
critical assessment of15
was isolated from15
with the target15
the onset of15
to follow the15
of the plant15
the aggregation process15
proteins from the15
with experimental data15
natural amino acids15
atoms in the15
value of the15
the endoplasmic reticulum15
can be classified15
this is due14
of severe acute14
even in the14
so as to14
such as those14
have been successfully14
the advantages of14
tested in vitro14
of physical chemistry14
to the corresponding14
the proliferation of14
identification of novel14
of sequence and14
widely used to14
destabilization of the14
the g protein14
of patients with14
models have been14
and the ability14
structures determined by14
of conformational changes14
of the side14
to the discovery14
than of the14
results will be14
and at the14
the success of14
stability of these14
introduced into the14
in all the14
is controlled by14
and formation of14
and application of14
and they are14
were performed to14
structure of sars14
been reported to14
was observed that14
identified as a14
ray structure of14
contact with the14
the protein was14
new family of14
lies in the14
instead of the14
to be in14
variety of biological14
in this presentation14
we have to14
in biological systems14
and the n14
conversion of the14
but also in14
the folding and14
step of the14
used to generate14
in the rna14
amino acid with14
protein to the14
may play a14
analogues of the14
we hypothesize that14
a collection of14
biological activity and14