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Application

Discovery Studio 1.0 Materials Studio 0.9780427137833433 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06495996391113117 Amorphous Cell 0.27562873576181346 Blends 0.002255554302469832 CASTEP 0.37904590053005527 CDOCKER 0.1675876846735085 CHARMm 0.26401263110409384 COMPASS 0.3527686929062817 COMPASS III 0.08830495094169392 COSMObase 0.003947220029322206 COSMOconf 0.004736664035186647 COSMOmic 1.127777151234916E-4 COSMOperm 0.0013533325814818991 COSMOplex 2.255554302469832E-4 COSMOquick 0.0015788880117288823 COSMOtherm 0.06360663132964926 Cantera 0.0 Catalyst 0.11819104544941919 Classical Simulations 1.0 Conformers 6.766662907409496E-4 Crystallization 0.07150107138829367 DFTB Plus 0.0057516634712980715 DMol3 0.16927935040036088 DPD 0.002255554302469832 Discover 0.003383331453704748 Forcite 0.5315213713770159 GULP 0.023006653885192286 Kinetix 2.255554302469832E-4 LUDI 0.0038344423141987143 LibDock 0.07229051539415811 LigandFit 0.00496221946543363 MCSS 5.63888575617458E-4 MODELER 0.20378933122814932 MesoDyn 9.022217209879328E-4 Mesocite 0.0031577760234577645 Mesoscale 0.005977218901545055 Modules 0.0 Morphology 0.016803879553400246 ONETEP 0.0010149994361114245 Polymorph 0.002029998872222849 QMERA 1.127777151234916E-4 QSAR 0.001127777151234916 Quantum Mechanics 0.537047479418067 Reflex 0.051877748956806136 Reflex Plus 0.0010149994361114245 Semi-empirical 0.007104996052779971 Sorption 0.05605052441637533 Synthia 0.0015788880117288823 TURBOMOLE 4.511108604939664E-4 VAMP 0.0010149994361114245 Visualization 0.8300439833088982 X-Cell 0.0014661102966053907 ZDOCK 0.02898387278673734

Year

2022 0.023111510791366908 2023 0.3015287769784173 2024 0.5203237410071943 2025 1.0 2026 0.38219424460431656 2027 0.0

Keywords

target 1.0 potential 0.29323606768894844 docking 0.23095628008535557 visualization 0.20797975286586273 analysis 0.20296759466031464 between 0.1558731576596695 novel 0.10550344896034937 energy 0.08734057863133343 binding 0.07815989280928987 promising 0.06907845764478189 cell 0.06495955535705424 activity 0.05855788794600764 stability 0.041536400178651185 interaction 0.03607761401419284 synthesized 0.03255421567167883 performance 0.03230608902783981 experimental 0.02992407324698526 development 0.023720907151009874 effective 0.022778025904421618 including 0.0225298992605826 protein 0.022480273931814797 mechanism 0.02218252195920798 synthesis 0.01592973053446479 design 0.005061783534315915 chemical 0.0
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