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Application

Discovery Studio 1.0 Materials Studio 0.9610457063711911 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.059969690409179474 Amorphous Cell 0.27798224723966225 Blends 0.002164970772894566 CASTEP 0.32193115392942195 CDOCKER 0.17341415890885473 CHARMm 0.2775492530850833 COMPASS 0.33297250487118424 COMPASS III 0.10630006494912318 COSMObase 0.005195929854946958 COSMOconf 0.005845421086815328 COSMOmic 0.0 COSMOperm 4.3299415457891317E-4 COSMOplex 2.1649707728945658E-4 COSMOquick 0.001082485386447283 COSMOtherm 0.06538211734141589 Catalyst 0.0818358952154146 Classical Simulations 1.0 Conformers 4.3299415457891317E-4 Crystallization 0.07122753842823122 DFTB Plus 0.003247456159341849 DMol3 0.14894998917514612 DPD 0.0023814678501840225 Discover 0.004329941545789132 Forcite 0.5187269971855379 GULP 0.0179692574150249 Kinetix 2.1649707728945658E-4 LUDI 0.004113444468499676 LibDock 0.07295951504654687 LigandFit 0.004329941545789132 MCSS 2.1649707728945658E-4 MODELER 0.2602294869019268 MesoDyn 6.494912318683698E-4 Mesocite 0.0030309590820523924 Mesoscale 0.005845421086815328 Modules 0.0 Morphology 0.016670274951288158 ONETEP 8.659883091578263E-4 Polymorph 0.0019484736956051094 QMERA 2.1649707728945658E-4 QSAR 4.3299415457891317E-4 Quantum Mechanics 0.46178826585841093 Reflex 0.05152630439489067 Reflex Plus 6.494912318683698E-4 Semi-empirical 0.004762935700368045 Sorption 0.05563974886339034 Synthia 0.001082485386447283 TURBOMOLE 0.0 VAMP 8.659883091578263E-4 Visualization 0.7163888287508119 X-Cell 0.0012989824637367395 ZDOCK 0.029660099588655554

Year

2023 0.0 2024 0.4425615412058509 2025 1.0 2026 0.7466999643239386 2027 0.0017838030681412772

Keywords

target 1.0 potential 0.30818068276436306 docking 0.2309533721898418 analysis 0.2197127393838468 visualization 0.1694421315570358 between 0.1469608659450458 novel 0.09564945878434637 promising 0.0888842631140716 binding 0.07847626977518735 energy 0.07337635303913405 cell 0.06213572023313905 activity 0.051311407160699415 stability 0.041631973355537054 performance 0.03642797668609492 including 0.02497918401332223 development 0.0190466278101582 synthesized 0.018318068276436304 effective 0.01696502914238135 mechanism 0.015611990008326394 experimental 0.012801831806827644 enhanced 0.012281432139883431 strong 0.011344712739383847 interaction 0.01030391340549542 protein 0.005516236469608659 design 0.0
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