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Application

Discovery Studio 1.0 Materials Studio 0.822291725902758 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05626204238921002 Amorphous Cell 0.2605009633911368 Blends 0.0023121387283236996 CASTEP 0.28015414258188825 CDOCKER 0.1857418111753372 CHARMm 0.3067437379576108 COMPASS 0.3233140655105973 COMPASS III 0.09903660886319846 COSMObase 0.0038535645472061657 COSMOconf 0.006936416184971098 COSMOmic 0.0 COSMOperm 7.707129094412332E-4 COSMOplex 3.853564547206166E-4 COSMOquick 0.0 COSMOtherm 0.06011560693641618 Catalyst 0.08786127167630058 Classical Simulations 1.0 Conformers 3.853564547206166E-4 Crystallization 0.07129094412331406 DFTB Plus 0.0015414258188824663 DMol3 0.1329479768786127 DPD 0.0015414258188824663 Discover 0.005780346820809248 Forcite 0.500578034682081 GULP 0.01348747591522158 Kinetix 0.0 LUDI 0.004624277456647399 LibDock 0.08053949903660887 LigandFit 0.005009633911368015 MCSS 3.853564547206166E-4 MODELER 0.2813102119460501 MesoDyn 7.707129094412332E-4 Mesocite 0.003468208092485549 Mesoscale 0.005780346820809248 Morphology 0.01695568400770713 ONETEP 7.707129094412332E-4 Polymorph 0.0019267822736030828 QMERA 0.0 QSAR 3.853564547206166E-4 Quantum Mechanics 0.40655105973025046 Reflex 0.051252408477842 Reflex Plus 0.0 Semi-empirical 0.002697495183044316 Sorption 0.051252408477842 Synthia 0.0 TURBOMOLE 0.0 VAMP 3.853564547206166E-4 Visualization 0.7495183044315993 X-Cell 0.0015414258188824663 ZDOCK 0.03275529865125241

Year

2024 0.30227345501120717 2025 1.0 2026 0.8968940121677874 2027 0.0

Keywords

target 1.0 potential 0.32745355601426157 docking 0.2597110151998499 analysis 0.22987427284668793 visualization 0.18089697879527117 between 0.13736160630512292 novel 0.10302120472884219 binding 0.0970163257646838 promising 0.09682867329705386 activity 0.05817226496528429 cell 0.053856258209795456 energy 0.045974854569337587 stability 0.03940701820228936 including 0.028898480015012197 strong 0.026646650403452807 development 0.02195533871270407 therapeutic 0.01932820416588478 performance 0.01914055169825483 synthesized 0.014636892475136049 effective 0.013886282604616251 mechanism 0.013510977669356352 protein 0.009757928316757366 enhanced 0.006192531431788328 interaction 0.003377744417339088 design 0.0
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