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Application

Discovery Studio 0.9632362630122546 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06186077202243484 Amorphous Cell 0.2840646651270208 Blends 0.001979544704717915 CASTEP 0.34510062685582316 CDOCKER 0.1628175519630485 CHARMm 0.2603101286704058 COMPASS 0.348399868030353 COMPASS III 0.0999670075882547 COSMObase 0.004453975585615309 COSMOconf 0.005608709996700759 COSMOmic 0.0 COSMOperm 4.948861761794787E-4 COSMOplex 1.649620587264929E-4 COSMOquick 0.0014846585285384361 COSMOtherm 0.06400527878587925 Catalyst 0.08528538436159683 Classical Simulations 1.0 Conformers 3.299241174529858E-4 Crystallization 0.07126360936984494 DFTB Plus 0.004453975585615309 DMol3 0.1558891454965358 DPD 0.002144506763444408 Discover 0.003464203233256351 Forcite 0.5349719564500165 GULP 0.019465522929726163 Kinetix 1.649620587264929E-4 LUDI 0.003464203233256351 LibDock 0.06961398878258 LigandFit 0.00395908940943583 MCSS 4.948861761794787E-4 MODELER 0.2489277466182778 MesoDyn 6.598482349059716E-4 Mesocite 0.0031342791158033654 Mesoscale 0.005608709996700759 Modules 0.0 Morphology 0.016166281755196306 ONETEP 8.248102936324645E-4 Polymorph 0.001979544704717915 QMERA 1.649620587264929E-4 QSAR 6.598482349059716E-4 Quantum Mechanics 0.49142197294622236 Reflex 0.051798086440118775 Reflex Plus 9.897723523589574E-4 Semi-empirical 0.0059386341141537445 Sorption 0.05625206202573408 Synthia 9.897723523589574E-4 TURBOMOLE 3.299241174529858E-4 VAMP 9.897723523589574E-4 Visualization 0.7123061695809964 X-Cell 0.0014846585285384361 ZDOCK 0.028868360277136258

Year

2023 0.005413766434648105 2024 0.5189481825212684 2025 1.0 2026 0.5474349059035833 2027 0.0

Keywords

target 1.0 potential 0.2990333645151232 docking 0.21367321484253196 analysis 0.2103211724352978 visualization 0.16697848456501402 between 0.15076395385095104 novel 0.09713127533520424 energy 0.08263174306205176 promising 0.07787652011225445 binding 0.07070470845026504 cell 0.063844714686623 activity 0.04653882132834425 performance 0.04061428125974431 stability 0.040224508886810104 including 0.022294979731836608 synthesized 0.019020891799189272 effective 0.01878702837542875 experimental 0.018709073900841908 mechanism 0.016292485188649827 development 0.016214530714062987 interaction 0.015512940442781415 enhanced 0.008964764577486748 protein 0.005067040848144684 strong 0.0022606797630183974 design 0.0
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