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PubPharm (15)
11
Investigation of HDAC8-ligands' intermolecular forces through molecular dynamics simulations : profiling of non-bonding energies to design potential compounds as new anti-cancer agents
enthalten in:
Journal of biomolecular structure & dynamics
| 2021
von
Dewaker, V.
|
Srivastava, A.
|
Arora, A.
| +1
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12
Molecular dynamics study of HDAC8-largazole analogues co-crystals for designing potential anticancer compounds
enthalten in:
Journal of biomolecular structure & dynamics
| 2020
von
Dewaker, V.
|
Srivastava, P.
|
Verma, S.
| +1
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13
In silico study and validation of phosphotransacetylase (PTA) as a putative drug target for Staphylococcus aureus by homology-based modelling and virtual screening
enthalten in:
Applied biochemistry and biotechnology
| 2012
von
Morya, V.
|
Dewaker, V.
|
Kim, E.
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14
In Silico Study and Validation of Phosphotransacetylase (PTA) as a Putative Drug Target for Staphylococcus aureus by Homology-Based Modelling and Virtual Screening
enthalten in:
Applied biochemistry and biotechnology / A
| 2012
von
Morya, V.
|
Dewaker, V.
|
Kim, E.
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15
In Silico Study and Validation of Phosphotransacetylase (PTA) as a Putative Drug Target for Staphylococcus aureus by Homology-Based Modelling and Virtual Screening
enthalten in:
Applied biochemistry and biotechnology
| 2012
von
Morya, V.
|
Dewaker, V.
|
Kim, E.
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Thema
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Journal Article
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Research Support, Non-U.S. Gov't
5
Ligands
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MD simulation
3
EC 3.5.1.98
3
Histone Deacetylases
3
NAMD
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Antineoplastic Agents
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HDAC8
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HDAC8 protein, human
2
Repressor Proteins
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Review
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Thiazoles
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docking
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molecular docking
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non-bonding energy
2
vorinostat
1
540
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58IFB293JI
1
789U1901C5
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Erscheinungszeitraum
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2020-
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2010-2019
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