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Application

Discovery Studio 0.843886272457701 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07080274686242008 Amorphous Cell 0.2917357328913095 Blends 0.0023679848448969927 CASTEP 0.4061094008998342 CDOCKER 0.14373668008524745 CHARMm 0.22993132843949798 COMPASS 0.36395927066066774 COMPASS III 0.09235140895098272 COSMObase 0.003551977267345489 COSMOconf 0.006156760596732181 COSMOmic 0.0 COSMOperm 0.0011839924224484964 COSMOplex 2.3679848448969926E-4 COSMOquick 9.47193937958797E-4 COSMOtherm 0.07222353776935828 Cantera 0.0 Catalyst 0.09945536348567369 Classical Simulations 1.0 Conformers 4.735969689793985E-4 Crystallization 0.07577551503670377 DFTB Plus 0.00639355908122188 DMol3 0.17475728155339806 DPD 0.002604783329386692 Discover 0.0028415818138763913 Forcite 0.5609756097560976 GULP 0.01894387875917594 Kinetix 2.3679848448969926E-4 LUDI 0.003788775751835188 LibDock 0.05967321809140422 LigandFit 0.003551977267345489 MCSS 7.103954534690978E-4 MODELER 0.1965427421264504 MesoDyn 4.735969689793985E-4 Mesocite 0.0030783802983660904 Mesoscale 0.006156760596732181 Morphology 0.018233483305706844 ONETEP 0.0016575893914278948 Polymorph 0.0011839924224484964 QMERA 0.0 QSAR 9.47193937958797E-4 Quantum Mechanics 0.5721051385271134 Reflex 0.05470044991712053 Reflex Plus 4.735969689793985E-4 Semi-empirical 0.008287946957139474 Sorption 0.05754203173099692 Synthia 0.0016575893914278948 TURBOMOLE 9.47193937958797E-4 VAMP 0.0014207909069381957 Visualization 0.7371536822164338 X-Cell 0.0011839924224484964 ZDOCK 0.024153445417949324

Year

2023 0.16971654108360243 2024 0.5138141370649444 2025 1.0 2026 0.3805166846071044 2027 0.0

Keywords

target 1.0 potential 0.279089738085015 docking 0.19493344783168742 analysis 0.19289394589952769 visualization 0.17453842851009016 between 0.1624087591240876 energy 0.09596393301846286 novel 0.09231429798196651 cell 0.06816230141691713 promising 0.06633748389866896 binding 0.056462000858737656 activity 0.04604980678402748 performance 0.04229282954057535 stability 0.041004723057106056 experimental 0.03456419063975955 synthesized 0.02994847574066123 interaction 0.024151996565049377 mechanism 0.02071704594246458 including 0.01942893945899528 development 0.018570201803349076 effective 0.01814083297552598 enhanced 0.010304851867754402 synthesis 0.00622584800343495 design 0.003971661657363675 chemical 0.0
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