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Application

Discovery Studio 1.0 Materials Studio 0.9574675324675325 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05761316872427984 Amorphous Cell 0.2796296296296296 Blends 0.0022633744855967077 CASTEP 0.32983539094650205 CDOCKER 0.1728395061728395 CHARMm 0.2744855967078189 COMPASS 0.33868312757201646 COMPASS III 0.10205761316872428 COSMObase 0.004732510288065843 COSMOconf 0.005555555555555556 COSMOmic 0.0 COSMOperm 4.1152263374485596E-4 COSMOplex 2.0576131687242798E-4 COSMOquick 0.00102880658436214 COSMOtherm 0.06481481481481481 Catalyst 0.08930041152263374 Classical Simulations 1.0 Conformers 4.1152263374485596E-4 Crystallization 0.07037037037037037 DFTB Plus 0.004320987654320987 DMol3 0.15288065843621398 DPD 0.0022633744855967077 Discover 0.004320987654320987 Forcite 0.5224279835390947 GULP 0.018724279835390947 Kinetix 2.0576131687242798E-4 LUDI 0.0034979423868312758 LibDock 0.07016460905349794 LigandFit 0.00411522633744856 MODELER 0.25967078189300413 MesoDyn 6.172839506172839E-4 Mesocite 0.002880658436213992 Mesoscale 0.005555555555555556 Modules 0.0 Morphology 0.016872427983539096 ONETEP 0.00102880658436214 Polymorph 0.0024691358024691358 QMERA 2.0576131687242798E-4 QSAR 6.172839506172839E-4 Quantum Mechanics 0.4734567901234568 Reflex 0.05 Reflex Plus 8.230452674897119E-4 Semi-empirical 0.005555555555555556 Sorption 0.056584362139917695 Synthia 0.00102880658436214 TURBOMOLE 2.0576131687242798E-4 VAMP 6.172839506172839E-4 Visualization 0.7390946502057614 X-Cell 0.0012345679012345679 ZDOCK 0.029012345679012345

Year

2023 0.017019167217448776 2024 0.4583608724388632 2025 1.0 2026 0.6728354263053536 2027 0.0

Keywords

target 1.0 potential 0.3087788131436979 docking 0.23099558607160373 analysis 0.21785188818048062 visualization 0.17596861206473763 between 0.14507111329082883 novel 0.09730259931338892 promising 0.0847474252084355 binding 0.07719470328592447 energy 0.07307503678273664 cell 0.06257969592937715 activity 0.05424227562530652 stability 0.038842569887199606 performance 0.03540951446787641 including 0.02040215792054929 synthesized 0.01902893575282001 development 0.01765571358509073 effective 0.01706718979892104 mechanism 0.01441883276115743 experimental 0.012947523295733203 interaction 0.010789602746444336 enhanced 0.008337420304070623 strong 0.005689063266307013 protein 0.0047081902893575285 synthesis 0.0
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