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Application

Discovery Studio 1.0 Materials Studio 0.968152013916767 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06385892826570792 Amorphous Cell 0.2746105118986475 Blends 0.0018832391713747645 CASTEP 0.34822804314329736 CDOCKER 0.1712035610340695 CHARMm 0.27820578668036294 COMPASS 0.3412086971409005 COMPASS III 0.09227871939736347 COSMObase 0.004451292586885807 COSMOconf 0.005136106831022085 COSMOmic 0.0 COSMOperm 6.84814244136278E-4 COSMOplex 1.712035610340695E-4 COSMOquick 0.001712035610340695 COSMOtherm 0.06248929977743537 Cantera 0.0 Catalyst 0.09809964047252183 Classical Simulations 1.0 Conformers 6.84814244136278E-4 Crystallization 0.07019346002396849 DFTB Plus 0.004280089025851737 DMol3 0.1583632939565143 DPD 0.0022256462934429036 Discover 0.0039376819037835985 Forcite 0.5226844718370142 GULP 0.019003595274781716 Kinetix 0.0 LUDI 0.0039376819037835985 LibDock 0.07122068139017292 LigandFit 0.004108885464817668 MCSS 6.84814244136278E-4 MODELER 0.23934257832562916 MesoDyn 5.136106831022085E-4 Mesocite 0.0035952747817154596 Mesoscale 0.005820921075158364 Morphology 0.015408320493066256 ONETEP 0.001027221366204417 Polymorph 0.0018832391713747645 QMERA 1.712035610340695E-4 QSAR 8.560178051703475E-4 Quantum Mechanics 0.49734634480397194 Reflex 0.05187467899332306 Reflex Plus 6.84814244136278E-4 Semi-empirical 0.005820921075158364 Sorption 0.05358671460366376 Synthia 6.84814244136278E-4 TURBOMOLE 3.42407122068139E-4 VAMP 0.001027221366204417 Visualization 0.7630542715288477 X-Cell 0.001712035610340695 ZDOCK 0.02824858757062147

Year

2023 0.12163602451372235 2024 0.44111377564614973 2025 1.0 2026 0.5444977351452172 2027 0.0

Keywords

target 1.0 potential 0.30465806141265134 docking 0.22993666319249578 analysis 0.2122985649001844 visualization 0.18327587589192657 between 0.14727812074080013 novel 0.09676902108554478 binding 0.0752024372644913 promising 0.07416018600176381 energy 0.07303776156498036 cell 0.05668243405756434 activity 0.047863384911408645 stability 0.03800208450252546 performance 0.02653732061252305 including 0.020684678906437905 synthesized 0.018600176380982922 interaction 0.01627515433336006 effective 0.014030305459793153 experimental 0.013629439589513348 development 0.012587188326785858 mechanism 0.010181993105107031 protein 0.010181993105107031 synthesis 8.819049146155697E-4 strong 4.8103904433576526E-4 enhanced 0.0
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