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Application

Discovery Studio 1.0 Materials Studio 0.04286892003297609 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.008842443729903537 Amorphous Cell 0.01527331189710611 Blends 0.0 CASTEP 0.011254019292604502 CDOCKER 0.22909967845659163 CHARMm 0.4067524115755627 COMPASS 0.02491961414790997 COMPASS III 0.00482315112540193 COSMOconf 0.0 COSMOmic 0.0 COSMOperm 8.038585209003215E-4 COSMOquick 8.038585209003215E-4 COSMOtherm 0.00482315112540193 Catalyst 0.14790996784565916 Classical Simulations 0.4678456591639871 Conformers 0.0 Crystallization 0.007234726688102894 DMol3 0.01045016077170418 Forcite 0.04501607717041801 GULP 8.038585209003215E-4 LUDI 0.008038585209003215 LibDock 0.13745980707395497 LigandFit 0.011254019292604502 MODELER 0.30064308681672025 Morphology 0.001607717041800643 Polymorph 8.038585209003215E-4 QSAR 0.0 Quantum Mechanics 0.02090032154340836 Reflex 0.003215434083601286 Sorption 0.001607717041800643 Visualization 1.0 ZDOCK 0.04983922829581994

Year

2022 0.01694915254237288 2023 0.2551789077212806 2024 0.9124293785310734 2025 1.0 2026 0.0

Keywords

therapeutic 1.0 target 0.9566733067729084 potential 0.6792828685258964 docking 0.547808764940239 visualization 0.34860557768924305 analysis 0.3286852589641434 binding 0.23306772908366533 treatment 0.1852589641434263 promising 0.17928286852589642 novel 0.16533864541832669 drug 0.12848605577689243 protein 0.12201195219123506 vitro 0.09611553784860558 activity 0.0946215139442231 including 0.061254980079681276 silico 0.05029880478087649 development 0.04731075697211155 inhibition 0.038346613545816734 targeting 0.03187250996015936 between 0.014940239043824702 interaction 0.012948207171314742 efficacy 0.00846613545816733 compound 0.006474103585657371 effective 0.005478087649402391 potent 0.0
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