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Application

Discovery Studio 0.9991674298559654 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06588184469165137 Amorphous Cell 0.2771357598012744 Blends 0.0023760665298628364 CASTEP 0.38362674154876336 CDOCKER 0.16470461172912843 CHARMm 0.2612593152608273 COMPASS 0.3565179825035101 COMPASS III 0.08607841019548547 COSMObase 0.003780105842963603 COSMOconf 0.004536127011556324 COSMOmic 1.0800302408467438E-4 COSMOperm 0.0014040393131007668 COSMOplex 2.1600604816934875E-4 COSMOquick 0.0015120423371854411 COSMOtherm 0.0636137811858732 Cantera 0.0 Catalyst 0.12042337185441192 Classical Simulations 1.0 Conformers 6.480181445080463E-4 Crystallization 0.07268603520898585 DFTB Plus 0.005832163300572416 DMol3 0.17032076898153148 DPD 0.0024840695539475105 Discover 0.003240090722540231 Forcite 0.5322389026892753 GULP 0.023328653202289665 Kinetix 2.1600604816934875E-4 LUDI 0.004104114915217626 LibDock 0.07009396263095366 LigandFit 0.005076142131979695 MCSS 5.400151204233718E-4 MODELER 0.1973215250027001 MesoDyn 9.720272167620693E-4 Mesocite 0.003240090722540231 Mesoscale 0.006264175396911114 Modules 0.0 Morphology 0.017388486877632572 ONETEP 0.0010800302408467436 Polymorph 0.0019440544335241386 QMERA 1.0800302408467438E-4 QSAR 0.0010800302408467436 Quantum Mechanics 0.5431472081218274 Reflex 0.05259747272923642 Reflex Plus 9.720272167620693E-4 Semi-empirical 0.007344205637757857 Sorption 0.05637757857220002 Synthia 0.0014040393131007668 TURBOMOLE 5.400151204233718E-4 VAMP 0.0011880332649314182 Visualization 0.8235230586456421 X-Cell 0.0014040393131007668 ZDOCK 0.027972783237930662

Year

2022 0.013295514979613544 2023 0.3386810849140223 2024 0.5571707144123382 2025 1.0 2026 0.37679489452224785 2027 0.0

Keywords

target 1.0 potential 0.289034962370201 docking 0.22606458988282366 visualization 0.20563018005144326 analysis 0.1987710774507002 between 0.15499666571401352 novel 0.10512527388777745 energy 0.08883490521101267 binding 0.07606935314851862 promising 0.06611412784605125 cell 0.06516147470705916 activity 0.05625416785748309 stability 0.04001143183766791 interaction 0.036105553967800325 performance 0.03258073735352958 synthesized 0.03219967609793274 experimental 0.030389635133847764 development 0.02286367533581023 effective 0.02224445079546537 mechanism 0.02162522625512051 including 0.02119653234257407 protein 0.020910736400876442 synthesis 0.014861388968276651 design 0.005001428979708488 chemical 0.0
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