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Application

Discovery Studio 1.0 Materials Studio 0.8954453254656094 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.065141527723924 Amorphous Cell 0.2703890396794623 Blends 0.0024557321959415793 CASTEP 0.36318986687346516 CDOCKER 0.18379216750678556 CHARMm 0.28383094222566885 COMPASS 0.34780922838309425 COMPASS III 0.08427038903967947 COSMObase 0.0034897246994959287 COSMOconf 0.0032312265736073415 COSMOmic 0.0 COSMOperm 0.0011632415664986429 COSMOplex 1.2924906294429367E-4 COSMOquick 0.0016802378182758176 COSMOtherm 0.05997156520615225 Cantera 0.0 Catalyst 0.12446684761535479 Classical Simulations 1.0 Conformers 7.754943776657619E-4 Crystallization 0.06966524492697428 DFTB Plus 0.005169962517771746 DMol3 0.17073801214941192 DPD 0.0023264831329972858 Discover 0.0032312265736073415 Forcite 0.5149282667700659 GULP 0.022877084141139977 Kinetix 1.2924906294429367E-4 LUDI 0.004911464391883159 LibDock 0.0794881737107406 LigandFit 0.006591702210158977 MCSS 5.169962517771747E-4 MODELER 0.21830166731291198 MesoDyn 0.0011632415664986429 Mesocite 0.004006720951273103 Mesoscale 0.006979449398991857 Modules 0.0 Morphology 0.016156132868036705 ONETEP 9.047434406100556E-4 Polymorph 0.0019387359441644049 QMERA 2.5849812588858733E-4 QSAR 9.047434406100556E-4 Quantum Mechanics 0.5232002067985007 Reflex 0.050924130800051697 Reflex Plus 9.047434406100556E-4 Semi-empirical 0.006979449398991857 Sorption 0.053509112058937575 Synthia 0.0010339925035543493 TURBOMOLE 3.8774718883288094E-4 VAMP 0.0012924906294429364 Visualization 0.8574382835724441 X-Cell 0.0014217396923872302 ZDOCK 0.03282926198785059

Year

2021 0.0 2022 0.1609106052193226 2023 0.23564686285397002 2024 0.6607440310938367 2025 1.0 2026 0.3549139367018323

Keywords

target 1.0 potential 0.2951239899693508 docking 0.23833937029813318 visualization 0.21092226246865423 analysis 0.1986625801058791 between 0.1506269155753692 novel 0.10777375313457788 binding 0.08353301755363611 energy 0.07796043466146559 promising 0.06625801058790749 activity 0.061744218445249376 cell 0.061131234327110616 stability 0.03945388687656729 interaction 0.03778211200891613 synthesized 0.030872109222624688 protein 0.0278071886319309 development 0.025745332961827808 experimental 0.025020897185845638 effective 0.023794928949568125 performance 0.023181944831429366 including 0.02223460573976038 mechanism 0.020562830872109222 synthesis 0.016383393702981332 design 0.005293953747561995 silico 0.0
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