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Application

Discovery Studio 1.0 Materials Studio 0.9874730975111748 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0686772170797253 Amorphous Cell 0.2762018512988952 Blends 0.0029113168109883548 CASTEP 0.41019707375335923 CDOCKER 0.1757240967452971 CHARMm 0.2568677217079725 COMPASS 0.37458942968050163 COMPASS III 0.07263362197670946 COSMObase 0.0029113168109883548 COSMOconf 0.0032845625559868616 COSMOmic 2.239474469991042E-4 COSMOperm 0.0012690355329949238 COSMOplex 3.73245744998507E-4 COSMOquick 0.0017169304269931322 COSMOtherm 0.0635264257987459 Cantera 0.0 Catalyst 0.12115556882651538 Classical Simulations 1.0 Conformers 0.0011943863839952225 Crystallization 0.07629143027769483 DFTB Plus 0.005747984472977008 DMol3 0.18863839952224545 DPD 0.0032845625559868616 Discover 0.004702896386981188 Forcite 0.533517467900866 GULP 0.027321588533890714 Kinetix 2.239474469991042E-4 LUDI 0.005449387876978203 LibDock 0.07091669154971633 LigandFit 0.007763511495968946 MCSS 0.0012690355329949238 MODELER 0.18863839952224545 MesoDyn 0.0016422812779934308 Mesocite 0.004702896386981188 Mesoscale 0.008360704687966557 Modules 0.0 Morphology 0.017691848312929234 ONETEP 0.0013436846819946252 Polymorph 0.0019408778739922366 QMERA 2.239474469991042E-4 QSAR 0.0013436846819946252 Quantum Mechanics 0.5869662585846521 Reflex 0.05636010749477456 Reflex Plus 7.46491489997014E-4 Semi-empirical 0.007763511495968946 Sorption 0.053971334726784115 Synthia 0.0014183338309943267 TURBOMOLE 5.225440429979098E-4 VAMP 0.0016422812779934308 Visualization 0.8758584652134965 X-Cell 0.0011943863839952225 ZDOCK 0.030755449387876978

Year

2020 0.06327119978997112 2021 0.1648726699921239 2022 0.2988535923689507 2023 0.49645576266736674 2024 0.9796972083661504 2025 1.0 2026 0.3720136518771331 2027 0.0

Keywords

target 1.0 potential 0.25598138774483603 docking 0.2122488760335775 visualization 0.2096708271764077 analysis 0.17376678089728675 between 0.15251359763574057 novel 0.09834313201496526 energy 0.08158581444336152 binding 0.06784670041185903 cell 0.05734586726192348 activity 0.05071210739774264 promising 0.04244348728267362 interaction 0.039016568679850344 experimental 0.02732102996195806 synthesized 0.027258150721539285 stability 0.025214575407929072 protein 0.01873801364479517 mechanism 0.017197472254535166 effective 0.015531172383437607 development 0.014870940359040463 performance 0.013927751752758826 synthesis 0.011412582136007796 including 0.005690571257899205 chemical 6.287924041877575E-4 design 0.0
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