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Application

Discovery Studio 0.8926701570680629 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07194470625196356 Amorphous Cell 0.2673578385171222 Blends 0.004398366321080742 CASTEP 0.4800502670436695 CDOCKER 0.1520578071002199 CHARMm 0.23782595036129436 COMPASS 0.4213006597549482 COMPASS III 0.027961043041156142 COSMObase 3.1416902293433867E-4 COSMOconf 0.0012566760917373547 COSMOmic 3.1416902293433867E-4 COSMOperm 9.42507068803016E-4 COSMOplex 6.283380458686773E-4 COSMOquick 0.002199183160540371 COSMOtherm 0.07194470625196356 Catalyst 0.16808042726987119 Classical Simulations 1.0 Conformers 0.0034558592522777255 Crystallization 0.08796732642161482 DFTB Plus 0.006283380458686773 DMol3 0.2519635563933396 DPD 0.00471253534401508 Discover 0.010681746779767515 Forcite 0.5309456487590324 GULP 0.04272698711907006 LUDI 0.0059692114357524344 LibDock 0.06220546654099906 LigandFit 0.006911718504555451 MCSS 3.1416902293433867E-4 MODELER 0.0666038328620798 MesoDyn 0.0031416902293433867 Mesocite 0.006597549481621112 Mesoscale 0.012880929940307886 Morphology 0.022306000628338044 ONETEP 0.001885014137606032 Polymorph 0.002199183160540371 QMERA 9.42507068803016E-4 QSAR 0.0025133521834747093 Quantum Mechanics 0.7119070059692114 Reflex 0.06377631165567076 Reflex Plus 9.42507068803016E-4 Reflex QPA 0.0 Semi-empirical 0.010995915802701853 Sorption 0.051523719761231546 Synthia 6.283380458686773E-4 TURBOMOLE 9.42507068803016E-4 VAMP 0.0031416902293433867 Visualization 0.9092051523719761 X-Cell 0.0015708451146716933 ZDOCK 0.025133521834747093

Year

2023 0.0

Keywords

target 1.0 visualization 0.21359102244389028 docking 0.2011221945137157 potential 0.1917705735660848 between 0.1502493765586035 analysis 0.13503740648379053 energy 0.08366583541147132 novel 0.07256857855361595 binding 0.05336658354114713 cell 0.05062344139650873 interaction 0.05 experimental 0.04389027431421447 activity 0.0428927680798005 synthesized 0.02942643391521197 mechanism 0.02319201995012469 protein 0.023067331670822942 chemical 0.017082294264339153 well 0.010972568578553617 synthesis 0.00860349127182045 stability 0.006608478802992519 promising 0.005236907730673317 compound 0.003491271820448878 higher 0.002369077306733167 development 0.002119700748129676 design 0.0
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