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Chekmarev, Dmitriy
18
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1
Imputation of sensory properties using deep learning:
Mahmoud, Samar
;
Irwin, Benedict
;
Chekmarev, Dmitriy
...
Journal of Computer-Aided Molecular Design. 35 (2021) 11 - p. 1125-1140 , 2021
Link:
https://doi.org/10.1007/..
?
2
Online chemical modeling environment (OCHEM): web platform ..:
Sushko, Iurii
;
Novotarskyi, Sergii
;
Körner, Robert
...
Journal of Computer-Aided Molecular Design. 25 (2011) 6 - p. 533-554 , 2011
Link:
https://doi.org/10.1007/..
?
3
Predicting Inhibitors of Acetylcholinesterase by Regression..:
Chekmarev, Dmitriy
;
Kholodovych, Vladyslav
;
Kortagere, Sandhya
..
Pharmaceutical Research. 26 (2009) 9 - p. 2216-2224 , 2009
Link:
https://doi.org/10.1007/..
?
4
Prediction of Protein Loop Conformations Using the AGBNP Im..:
Felts, Anthony K.
;
Gallicchio, Emilio
;
Chekmarev, Dmitriy
...
Journal of Chemical Theory and Computation. 4 (2008) 5 - p. 855-868 , 2008
Link:
https://doi.org/10.1021/..
?
5
One-Pot Four-Component Reaction for the Generation of Pyraz..:
Stonehouse, Jeffrey
;
Chekmarev, Dmitriy
;
Ivanova, Natalya
...
Synlett. 2008 (2008) 1 - p. 100-104 , 2008
Link:
https://doi.org/10.1055/..
?
6
Hybrid Scoring and Classification Approaches to Predict Hum..:
Kortagere, Sandhya
;
Chekmarev, Dmitriy
;
Welsh, William J.
.
Pharmaceutical Research. 26 (2008) 4 - p. 1001-1011 , 2008
Link:
https://doi.org/10.1007/..
?
7
New Predictive Models for Blood–Brain Barrier Permeability ..:
Kortagere, Sandhya
;
Chekmarev, Dmitriy
;
Welsh, William J.
.
Pharmaceutical Research. 25 (2008) 8 - p. 1836-1845 , 2008
Link:
https://doi.org/10.1007/..
?
8
Quantum Monte Carlo simulations of the structure in the liq..:
Zhao, Meishan
;
Chekmarev, Dmitriy
;
Rice, Stuart A.
The Journal of Chemical Physics. 108 (1998) 12 - p. 5055-5067 , 1998
Link:
https://doi.org/10.1063/..
?
9
Structure of the liquid–vapor interface of a metal from a s..:
Chekmarev, Dmitriy
;
Zhao, Meishan
;
Rice, Stuart A.
The Journal of Chemical Physics. 109 (1998) 2 - p. 768-778 , 1998
Link:
https://doi.org/10.1063/..
?
10
Comparison of the structures of the liquid-vapor interfaces..:
Zhao, Meishan
;
Chekmarev, Dmitriy
;
Rice, Stuart A.
The Journal of Chemical Physics. 109 (1998) 5 - p. 1959-1965 , 1998
Link:
https://doi.org/10.1063/..
?
11
Discovery of flavouring compounds to substitute fatty and t..:
Chekmarev, Dmitriy S.
;
Da Costa, Neil C.
;
Darling, Jason M.
...
International Journal of Food Science & Technology. 57 (2022) 9 - p. 6181-6190 , 2022
Link:
https://doi.org/10.1111/..
?
12
Shape Signatures: New Descriptors for Predicting Cardiotoxi..:
Chekmarev, Dmitriy S.
;
Kholodovych, Vladyslav
;
Balakin, Konstantin V.
...
Chemical Research in Toxicology. 21 (2008) 6 - p. 1304-1314 , 2008
Link:
https://doi.org/10.1021/..
?
13
Highly selective substitutions in 2,3-dichloropyrazine. A n..:
Chekmarev, Dmitriy S.
;
Shorshnev, Sergey V.
;
Stepanov, Alexander E.
.
Tetrahedron. 62 (2006) 42 - p. 9919-9930 , 2006
Link:
https://doi.org/10.1016/..
?
14
Highly selective mono-substitution in Pd-catalyzed cross-co..:
Chekmarev, Dmitriy S.
;
Stepanov, Alexander E.
;
Kasatkin, Alexander N.
Tetrahedron Letters. 46 (2005) 8 - p. 1303-1305 , 2005
Link:
https://doi.org/10.1016/..
?
15
Long-Time Conformational Transitions of Alanine Dipeptide i..:
Chekmarev, Dmitriy S.
;
Ishida, Tateki
;
Levy, Ronald M.
The Journal of Physical Chemistry B. 108 (2004) 50 - p. 19487-19495 , 2004
Link:
https://doi.org/10.1021/..
1-15