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Application

Discovery Studio 1.0 Materials Studio 0.9060917002208079 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06176875430144529 Amorphous Cell 0.2727116311080523 Blends 0.0018926359256710254 CASTEP 0.3336200963523744 CDOCKER 0.18083275980729524 CHARMm 0.2895732966276669 COMPASS 0.3301789401238816 COMPASS III 0.09772883688919477 COSMObase 0.0039573296627666895 COSMOconf 0.006022023399862354 COSMOmic 0.0 COSMOperm 5.161734342739161E-4 COSMOplex 1.7205781142463867E-4 COSMOquick 0.0013764624913971094 COSMOtherm 0.06503785271851342 Catalyst 0.10134205092911218 Classical Simulations 1.0 Conformers 3.4411562284927734E-4 Crystallization 0.06882312456985547 DFTB Plus 0.004989676531314522 DMol3 0.1503785271851342 DPD 0.002236751548520303 Discover 0.0029249827942188574 Forcite 0.5153131452167928 GULP 0.0182381280110117 Kinetix 1.7205781142463867E-4 LUDI 0.003785271851342051 LibDock 0.07536132140399174 LigandFit 0.004301445285615967 MCSS 5.161734342739161E-4 MODELER 0.25739848589125947 MesoDyn 6.882312456985547E-4 Mesocite 0.00258086717136958 Mesoscale 0.00516173434273916 Modules 0.0 Morphology 0.016001376462491397 ONETEP 0.0010323468685478321 Polymorph 0.0017205781142463868 QMERA 0.0 QSAR 8.602890571231934E-4 Quantum Mechanics 0.47573984858912594 Reflex 0.049724707501720575 Reflex Plus 8.602890571231934E-4 Semi-empirical 0.00653819683413627 Sorption 0.053854094975911905 Synthia 0.0010323468685478321 TURBOMOLE 5.161734342739161E-4 VAMP 0.0012044046799724708 Visualization 0.7730557467309016 X-Cell 0.0015485203028217482 ZDOCK 0.030282174810736407

Year

2023 0.055727155727155725 2024 0.531016731016731 2025 1.0 2026 0.44954954954954957 2027 0.0

Keywords

target 1.0 potential 0.28577693319690106 docking 0.22167811723432246 analysis 0.19536617453588656 visualization 0.17205086975588366 between 0.13733372313989184 novel 0.09720801052477708 binding 0.0766700774740535 promising 0.07250401988013448 energy 0.06716854261072942 cell 0.05598596696389417 activity 0.05408565999122935 stability 0.034644057886273935 performance 0.024923256833796228 including 0.022072796374799006 synthesized 0.021195731618184475 interaction 0.01878380353749452 effective 0.018418359888905132 development 0.017102762753983335 protein 0.01586025434877942 mechanism 0.014471568484139746 experimental 0.013229060078935827 synthesis 0.008259026458120157 enhanced 0.0022657506212542026 design 0.0
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