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Application

Discovery Studio 0.8641099026903263 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07072419106317411 Amorphous Cell 0.2929121725731895 Blends 0.002465331278890601 CASTEP 0.3964560862865948 CDOCKER 0.14822804314329738 CHARMm 0.22973805855161789 COMPASS 0.37473035439137137 COMPASS III 0.08613251155624037 COSMObase 0.0032357473035439137 COSMOconf 0.005084745762711864 COSMOmic 1.5408320493066256E-4 COSMOperm 0.001386748844375963 COSMOplex 4.622496147919877E-4 COSMOquick 6.163328197226503E-4 COSMOtherm 0.06856702619414484 Cantera 0.0 Catalyst 0.11340523882896764 Classical Simulations 1.0 Conformers 7.704160246533128E-4 Crystallization 0.07688751926040062 DFTB Plus 0.0064714946070878274 DMol3 0.17796610169491525 DPD 0.0030816640986132513 Discover 0.004006163328197226 Forcite 0.5577812018489985 GULP 0.022187981510015407 Kinetix 3.081664098613251E-4 LUDI 0.004160246533127889 LibDock 0.061787365177195686 LigandFit 0.004776579352850539 MCSS 4.622496147919877E-4 MODELER 0.17087827426810479 MesoDyn 6.163328197226503E-4 Mesocite 0.003852080123266564 Mesoscale 0.006779661016949152 Morphology 0.018335901386748843 ONETEP 0.001386748844375963 Polymorph 0.001694915254237288 QMERA 3.081664098613251E-4 QSAR 9.244992295839754E-4 Quantum Mechanics 0.565331278890601 Reflex 0.05593220338983051 Reflex Plus 4.622496147919877E-4 Semi-empirical 0.008628659476117103 Sorption 0.0576271186440678 Synthia 0.001386748844375963 TURBOMOLE 6.163328197226503E-4 VAMP 0.0015408320493066256 Visualization 0.7582434514637905 X-Cell 0.001386748844375963 ZDOCK 0.02727272727272727

Year

2022 0.09987911755817468 2023 0.3167119975823512 2024 0.7189483227561196 2025 1.0 2026 0.5235720761559384 2027 0.0

Keywords

target 1.0 potential 0.26811897779639715 docking 0.19557324396034073 analysis 0.1894288507191733 visualization 0.18258623097332774 between 0.15584415584415584 energy 0.09377181957827119 novel 0.09042033235581623 cell 0.06751850300237397 binding 0.06081552855746404 promising 0.05795279988828376 activity 0.04587348135735232 performance 0.039030861611506776 stability 0.038821393660103336 experimental 0.03358469487501745 interaction 0.028347996089931573 synthesized 0.027510124284317834 mechanism 0.02297165200391007 effective 0.01829353442256668 development 0.014872224549643905 including 0.014173998044965786 synthesis 0.005585812037424941 design 0.0011869850579527999 protein 6.284038542103058E-4 chemical 0.0
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