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Application

Discovery Studio 1.0 Materials Studio 0.4981941309255079 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.054098360655737705 Amorphous Cell 0.17991803278688526 Blends 0.0020491803278688526 CASTEP 0.27827868852459015 CDOCKER 0.22295081967213115 CHARMm 0.3602459016393443 COMPASS 0.2627049180327869 COMPASS III 0.029918032786885245 COSMObase 0.0 COSMOmic 4.098360655737705E-4 COSMOperm 0.0012295081967213116 COSMOplex 0.0 COSMOquick 4.098360655737705E-4 COSMOtherm 0.037295081967213116 Catalyst 0.14221311475409837 Classical Simulations 0.8540983606557377 Conformers 0.001639344262295082 Crystallization 0.05450819672131148 DFTB Plus 0.002459016393442623 DMol3 0.13114754098360656 DPD 0.0028688524590163933 Discover 0.0012295081967213116 Forcite 0.3569672131147541 GULP 0.022950819672131147 Kinetix 0.0 LUDI 0.0036885245901639345 LibDock 0.09344262295081968 LigandFit 0.006557377049180328 MCSS 0.0012295081967213116 MODELER 0.3401639344262295 MesoDyn 0.002459016393442623 Mesocite 0.002459016393442623 Mesoscale 0.007377049180327869 Morphology 0.010655737704918032 ONETEP 4.098360655737705E-4 Polymorph 0.0 QMERA 0.0 Quantum Mechanics 0.4016393442622951 Reflex 0.0430327868852459 Semi-empirical 0.004098360655737705 Sorption 0.03278688524590164 Synthia 0.0 TURBOMOLE 4.098360655737705E-4 VAMP 8.19672131147541E-4 Visualization 1.0 ZDOCK 0.03770491803278689

Year

2024 0.0

Keywords

target 1.0 potential 0.32193832599118943 docking 0.3180616740088106 visualization 0.2426431718061674 analysis 0.20986784140969164 between 0.12123348017621145 novel 0.10801762114537444 binding 0.10784140969162996 activity 0.07770925110132158 protein 0.05145374449339207 promising 0.03718061674008811 interaction 0.033480176211453744 synthesis 0.016740088105726872 vitro 0.015154185022026432 synthesized 0.014096916299559472 cell 0.01039647577092511 silico 0.007048458149779736 effective 0.006343612334801762 energy 0.004052863436123348 compound 0.0029955947136563878 development 0.0026431718061674008 including 0.0010572687224669603 stability 7.048458149779736E-4 drug 3.524229074889868E-4 mechanism 0.0
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